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Azoles

Organic compounds that consist of five-membered heterocyclic molecules containing a nitrogen atom and at least one other non-carbon atom as part of the ring.
Imidazoles (2,982)
Thiazoles (2,025)
Pyrazoles (1,495)
Triazoles (582)
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Oxadiazoles (242)
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961 – 975 of 6,965 results
961

4-(1-Imidazolyl)benzaldehyde 97.0+%, TCI America™

CAS: 10040-98-9 Molecular Formula: C10H8N2O Molecular Weight (g/mol): 172.187 MDL Number: MFCD00209977 InChI Key: DCICUQFMCRPKHZ-UHFFFAOYSA-N Synonym: 4-1h-imidazol-1-yl benzaldehyde,4-imidazol-1-yl-benzaldehyde,4-1-imidazolyl benzaldehyde,1-4-formylphenyl imidazole,4-imidazol-1-yl benzaldehyde,1-4-formylphenyl-1h-imidazole,4-1h-imidazol-1-yl-benzaldehyde,benzaldehyde, 4-1h-imidazol-1-yl,4-1h-imidazol-1-yl benzenecarbaldehyde,p-1-imidazolyl benzaldehyde PubChem CID: 736530 IUPAC Name: 4-imidazol-1-ylbenzaldehyde SMILES: C1=CC(=CC=C1C=O)N2C=CN=C2

PubChem CID 736530
CAS 10040-98-9
Molecular Weight (g/mol) 172.187
MDL Number MFCD00209977
SMILES C1=CC(=CC=C1C=O)N2C=CN=C2
Synonym 4-1h-imidazol-1-yl benzaldehyde,4-imidazol-1-yl-benzaldehyde,4-1-imidazolyl benzaldehyde,1-4-formylphenyl imidazole,4-imidazol-1-yl benzaldehyde,1-4-formylphenyl-1h-imidazole,4-1h-imidazol-1-yl-benzaldehyde,benzaldehyde, 4-1h-imidazol-1-yl,4-1h-imidazol-1-yl benzenecarbaldehyde,p-1-imidazolyl benzaldehyde
IUPAC Name 4-imidazol-1-ylbenzaldehyde
InChI Key DCICUQFMCRPKHZ-UHFFFAOYSA-N
Molecular Formula C10H8N2O
962

1-Phenyl-2-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1H-benzimidazole 98.0+%, TCI America™

CAS: 952514-86-2 Molecular Formula: C25H25BN2O2 Molecular Weight (g/mol): 396.297 MDL Number: MFCD16038225 InChI Key: IFFQSTWSRPRHBQ-UHFFFAOYSA-N Synonym: 3-(1-Phenyl-1H-benzimidazole-2-yl)phenylboronic Acid Pinacol Ester PubChem CID: 58184542 IUPAC Name: 1-phenyl-2-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]benzimidazole SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC=C2)C3=NC4=CC=CC=C4N3C5=CC=CC=C5

PubChem CID 58184542
CAS 952514-86-2
Molecular Weight (g/mol) 396.297
MDL Number MFCD16038225
SMILES B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC=C2)C3=NC4=CC=CC=C4N3C5=CC=CC=C5
Synonym 3-(1-Phenyl-1H-benzimidazole-2-yl)phenylboronic Acid Pinacol Ester
IUPAC Name 1-phenyl-2-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]benzimidazole
InChI Key IFFQSTWSRPRHBQ-UHFFFAOYSA-N
Molecular Formula C25H25BN2O2
963

2-(4-Bromophenyl)imidazo[1,2-a]pyridine 98.0+%, TCI America™

CAS: 34658-66-7 Molecular Formula: C13H9BrN2 Molecular Weight (g/mol): 273.13 MDL Number: MFCD00218250 InChI Key: GRZUOGFRIHABDK-UHFFFAOYSA-N Synonym: 2-4-bromophenyl imidazo 1,2-a pyridine,2-4-bromo-phenyl-imidazo 1,2-a pyridine,2-4-bromophenyl h-imidazo 1,2-a pyridine,acmc-1aihf,2-4-bromophenyl-imidazo 1,2-a pyridine,2-4-bromophenyl imidazo 1,2-? pyridine,2-4-bromophenyl imidazo 1,2-a pyridine #,imidazo 1,2-a pyridine,2-4-bromophenyl,imidazol 1,2-a pyridine, 2-4-bromophenyl PubChem CID: 623416 IUPAC Name: 2-(4-bromophenyl)imidazo[1,2-a]pyridine SMILES: BrC1=CC=C(C=C1)C1=CN2C=CC=CC2=N1

PubChem CID 623416
CAS 34658-66-7
Molecular Weight (g/mol) 273.13
MDL Number MFCD00218250
SMILES BrC1=CC=C(C=C1)C1=CN2C=CC=CC2=N1
Synonym 2-4-bromophenyl imidazo 1,2-a pyridine,2-4-bromo-phenyl-imidazo 1,2-a pyridine,2-4-bromophenyl h-imidazo 1,2-a pyridine,acmc-1aihf,2-4-bromophenyl-imidazo 1,2-a pyridine,2-4-bromophenyl imidazo 1,2-? pyridine,2-4-bromophenyl imidazo 1,2-a pyridine #,imidazo 1,2-a pyridine,2-4-bromophenyl,imidazol 1,2-a pyridine, 2-4-bromophenyl
IUPAC Name 2-(4-bromophenyl)imidazo[1,2-a]pyridine
InChI Key GRZUOGFRIHABDK-UHFFFAOYSA-N
Molecular Formula C13H9BrN2
964

1-Methyl-3-n-octylimidazolium Chloride 98.0+%, TCI America™

CAS: 64697-40-1 Molecular Formula: C12H23ClN2 Molecular Weight (g/mol): 230.78 MDL Number: MFCD03095432 InChI Key: OXFBEEDAZHXDHB-UHFFFAOYSA-M Synonym: 1-methyl-3-n-octylimidazolium chloride,1-methyl-3-octylimidazolium chloride,1-octyl-3-methylimidazolium chloride,3-methyl-1-octylimidazolium chloride,omimcl,acmc-20aj1j,dsstox_cid_27849,dsstox_rid_82602,dsstox_gsid_47873,ksc491c7j PubChem CID: 2734223 ChEBI: CHEBI:61342 IUPAC Name: 3-methyl-1-octyl-1H-imidazol-3-ium chloride SMILES: [Cl-].CCCCCCCCN1C=C[N+](C)=C1

PubChem CID 2734223
CAS 64697-40-1
Molecular Weight (g/mol) 230.78
ChEBI CHEBI:61342
MDL Number MFCD03095432
SMILES [Cl-].CCCCCCCCN1C=C[N+](C)=C1
Synonym 1-methyl-3-n-octylimidazolium chloride,1-methyl-3-octylimidazolium chloride,1-octyl-3-methylimidazolium chloride,3-methyl-1-octylimidazolium chloride,omimcl,acmc-20aj1j,dsstox_cid_27849,dsstox_rid_82602,dsstox_gsid_47873,ksc491c7j
IUPAC Name 3-methyl-1-octyl-1H-imidazol-3-ium chloride
InChI Key OXFBEEDAZHXDHB-UHFFFAOYSA-M
Molecular Formula C12H23ClN2
965

1-Butyl-2,3-dimethylimidazolium Trifluoromethanesulfonate 98.0+%, TCI America™

CAS: 765910-73-4 Molecular Formula: C10H17F3N2O3S Molecular Weight (g/mol): 302.312 MDL Number: MFCD03427624 InChI Key: KSOGGGZFEJTGPZ-UHFFFAOYSA-M Synonym: 1-butyl-2,3-dimethylimidazolium trifluoromethanesulfonate,1-butyl-2,3-dimethylimidazolium triflate,dsstox_cid_29315,dsstox_rid_83431,dsstox_gsid_49356,ksc496s6h,1-butyl-2,3-dimethylimidazol-1-ium triflate,3-butyl-1,2-dimethylimidazol-1-ium triflate,1-butyl-2,3-dimethylimidazolium trifluoromethansulfonate,1-butyl-2,3-dimethylimidazol-3-ium; trifluoromethanesulfonate PubChem CID: 2734250 IUPAC Name: 1-butyl-2,3-dimethylimidazol-3-ium;trifluoromethanesulfonate SMILES: CCCCN1C=C[N+](=C1C)C.C(F)(F)(F)S(=O)(=O)[O-]

PubChem CID 2734250
CAS 765910-73-4
Molecular Weight (g/mol) 302.312
MDL Number MFCD03427624
SMILES CCCCN1C=C[N+](=C1C)C.C(F)(F)(F)S(=O)(=O)[O-]
Synonym 1-butyl-2,3-dimethylimidazolium trifluoromethanesulfonate,1-butyl-2,3-dimethylimidazolium triflate,dsstox_cid_29315,dsstox_rid_83431,dsstox_gsid_49356,ksc496s6h,1-butyl-2,3-dimethylimidazol-1-ium triflate,3-butyl-1,2-dimethylimidazol-1-ium triflate,1-butyl-2,3-dimethylimidazolium trifluoromethansulfonate,1-butyl-2,3-dimethylimidazol-3-ium; trifluoromethanesulfonate
IUPAC Name 1-butyl-2,3-dimethylimidazol-3-ium;trifluoromethanesulfonate
InChI Key KSOGGGZFEJTGPZ-UHFFFAOYSA-M
Molecular Formula C10H17F3N2O3S
966

1-(Trifluoroacetyl)imidazole 98.0+%, TCI America™

CAS: 1546-79-8 Molecular Formula: C5H3F3N2O Molecular Weight (g/mol): 164.087 MDL Number: MFCD00014501 InChI Key: SINBGNJPYWNUQI-UHFFFAOYSA-N Synonym: 1-trifluoroacetyl imidazole,n-trifluoroacetylimidazole,1-trifluoroacetyl-1h-imidazole,1h-imidazole, 1-trifluoroacetyl,unii-8c6041ow3i,tfai,2,2,2-trifluoro-1-1h-imidazol-1-yl ethanone,n-trifluoroacetyl imidazole,2,2,2-trifluoro-1-imidazol-1-yl ethanone,2,2,2-trifluoro-1-1h-imidazol-1-yl ethan-1-one PubChem CID: 73767 IUPAC Name: 2,2,2-trifluoro-1-imidazol-1-ylethanone SMILES: C1=CN(C=N1)C(=O)C(F)(F)F

PubChem CID 73767
CAS 1546-79-8
Molecular Weight (g/mol) 164.087
MDL Number MFCD00014501
SMILES C1=CN(C=N1)C(=O)C(F)(F)F
Synonym 1-trifluoroacetyl imidazole,n-trifluoroacetylimidazole,1-trifluoroacetyl-1h-imidazole,1h-imidazole, 1-trifluoroacetyl,unii-8c6041ow3i,tfai,2,2,2-trifluoro-1-1h-imidazol-1-yl ethanone,n-trifluoroacetyl imidazole,2,2,2-trifluoro-1-imidazol-1-yl ethanone,2,2,2-trifluoro-1-1h-imidazol-1-yl ethan-1-one
IUPAC Name 2,2,2-trifluoro-1-imidazol-1-ylethanone
InChI Key SINBGNJPYWNUQI-UHFFFAOYSA-N
Molecular Formula C5H3F3N2O
967

1-Ethyl-3-methylimidazolium Bromide 98.0+%, TCI America™

CAS: 65039-08-9 Molecular Formula: C6H11BrN2 Molecular Weight (g/mol): 191.07 MDL Number: MFCD03427610 InChI Key: GWQYPLXGJIXMMV-UHFFFAOYSA-M Synonym: 1-ethyl-3-methylimidazolium bromide,3-ethyl-1-methyl-1h-imidazol-3-ium bromide,1-ethyl-3-methylmidazolium bromide,unii-xo254ye73i,1-ethyl-3-methyl-1h-imidazol-3-ium bromide,acmc-1b3a0,dsstox_cid_29300,dsstox_rid_83418,dsstox_gsid_49343,c6h11n2.br PubChem CID: 2734235 IUPAC Name: 1-ethyl-3-methyl-1H-imidazol-3-ium bromide SMILES: [Br-].CCN1C=C[N+](C)=C1

PubChem CID 2734235
CAS 65039-08-9
Molecular Weight (g/mol) 191.07
MDL Number MFCD03427610
SMILES [Br-].CCN1C=C[N+](C)=C1
Synonym 1-ethyl-3-methylimidazolium bromide,3-ethyl-1-methyl-1h-imidazol-3-ium bromide,1-ethyl-3-methylmidazolium bromide,unii-xo254ye73i,1-ethyl-3-methyl-1h-imidazol-3-ium bromide,acmc-1b3a0,dsstox_cid_29300,dsstox_rid_83418,dsstox_gsid_49343,c6h11n2.br
IUPAC Name 1-ethyl-3-methyl-1H-imidazol-3-ium bromide
InChI Key GWQYPLXGJIXMMV-UHFFFAOYSA-M
Molecular Formula C6H11BrN2
968

1-Butyl-3-methylimidazolium Tribromide 98.0+%, TCI America™

CAS: 820965-08-0 Molecular Formula: C8H15Br3N2 Molecular Weight (g/mol): 378.94 MDL Number: MFCD22199811 InChI Key: RHSQXXVEZYTZHB-UHFFFAOYSA-K PubChem CID: 91983981 IUPAC Name: 1-butyl-3-methyl-1H-imidazol-3-ium tribromide SMILES: [Br-].[Br-].[Br-].CCCCN1C=C[N+](C)=C1

PubChem CID 91983981
CAS 820965-08-0
Molecular Weight (g/mol) 378.94
MDL Number MFCD22199811
SMILES [Br-].[Br-].[Br-].CCCCN1C=C[N+](C)=C1
IUPAC Name 1-butyl-3-methyl-1H-imidazol-3-ium tribromide
InChI Key RHSQXXVEZYTZHB-UHFFFAOYSA-K
Molecular Formula C8H15Br3N2
969

1-(3-Aminopropyl)imidazole 97.0+%, TCI America™

CAS: 5036-48-6 Molecular Formula: C6H11N3 Molecular Weight (g/mol): 125.18 MDL Number: MFCD00009819 InChI Key: KDHWOCLBMVSZPG-UHFFFAOYSA-N Synonym: 1-3-aminopropyl imidazole,n-3-aminopropyl imidazole,1h-imidazole-1-propanamine,n-3-aminopropyl-imidazole,3-1h-imidazol-1-yl propan-1-amine,3-imidazol-1-ylpropylamine,3-1h-imidazol-1-yl-1-propanamine,1-3-aminopropyl-imidazole,3-imidazol-1-yl propylamine,3-imidazolylpropylamine PubChem CID: 78736 IUPAC Name: 3-(1H-imidazol-1-yl)propan-1-amine SMILES: NCCCN1C=CN=C1

PubChem CID 78736
CAS 5036-48-6
Molecular Weight (g/mol) 125.18
MDL Number MFCD00009819
SMILES NCCCN1C=CN=C1
Synonym 1-3-aminopropyl imidazole,n-3-aminopropyl imidazole,1h-imidazole-1-propanamine,n-3-aminopropyl-imidazole,3-1h-imidazol-1-yl propan-1-amine,3-imidazol-1-ylpropylamine,3-1h-imidazol-1-yl-1-propanamine,1-3-aminopropyl-imidazole,3-imidazol-1-yl propylamine,3-imidazolylpropylamine
IUPAC Name 3-(1H-imidazol-1-yl)propan-1-amine
InChI Key KDHWOCLBMVSZPG-UHFFFAOYSA-N
Molecular Formula C6H11N3
970

1-Ethyl-3-methylimidazolium Methyl Sulfate 98.0+%, TCI America™

CAS: 516474-01-4 Molecular Formula: C7H14N2O4S Molecular Weight (g/mol): 222.259 MDL Number: MFCD08457697 InChI Key: BXSDLSWVIAITRQ-UHFFFAOYSA-M Synonym: 1-ethyl-3-methylimidazolium methyl sulfate,1-ethyl-3-methylimidazolium methylsulfate,1-ethyl-3-methyl-1h-imidazol-3-ium methyl sulfate,1-ethyl-3-methylimidazolium methyl sulfate 1-,1-ethyl-3-methylimidazoliummethylsulfate,dsstox_cid_29266,dsstox_rid_83385,dsstox_gsid_49310,1-ethyl-3-methylimidazolium methylsul-fate,1-ethyl-3-methylimidazolium methyl sulfate hplc PubChem CID: 16211409 IUPAC Name: 1-ethyl-3-methylimidazol-3-ium;methyl sulfate SMILES: CCN1C=C[N+](=C1)C.COS(=O)(=O)[O-]

PubChem CID 16211409
CAS 516474-01-4
Molecular Weight (g/mol) 222.259
MDL Number MFCD08457697
SMILES CCN1C=C[N+](=C1)C.COS(=O)(=O)[O-]
Synonym 1-ethyl-3-methylimidazolium methyl sulfate,1-ethyl-3-methylimidazolium methylsulfate,1-ethyl-3-methyl-1h-imidazol-3-ium methyl sulfate,1-ethyl-3-methylimidazolium methyl sulfate 1-,1-ethyl-3-methylimidazoliummethylsulfate,dsstox_cid_29266,dsstox_rid_83385,dsstox_gsid_49310,1-ethyl-3-methylimidazolium methylsul-fate,1-ethyl-3-methylimidazolium methyl sulfate hplc
IUPAC Name 1-ethyl-3-methylimidazol-3-ium;methyl sulfate
InChI Key BXSDLSWVIAITRQ-UHFFFAOYSA-M
Molecular Formula C7H14N2O4S
971

1-Butyl-3-methylimidazolium Trifluoro(trifluoromethyl)borate 98.0+%, TCI America™

CAS: 741677-68-9 Molecular Formula: C9H15BF6N2 Molecular Weight (g/mol): 276.033 InChI Key: PTBVLMHYOBXNCB-UHFFFAOYSA-N PubChem CID: 44630030 IUPAC Name: 1-butyl-3-methylimidazol-3-ium;trifluoro(trifluoromethyl)boranuide SMILES: [B-](C(F)(F)F)(F)(F)F.CCCCN1C=C[N+](=C1)C

PubChem CID 44630030
CAS 741677-68-9
Molecular Weight (g/mol) 276.033
SMILES [B-](C(F)(F)F)(F)(F)F.CCCCN1C=C[N+](=C1)C
IUPAC Name 1-butyl-3-methylimidazol-3-ium;trifluoro(trifluoromethyl)boranuide
InChI Key PTBVLMHYOBXNCB-UHFFFAOYSA-N
Molecular Formula C9H15BF6N2
972

4,5-Diphenylimidazole 98.0+%, TCI America™

CAS: 668-94-0 Molecular Formula: C15H12N2 Molecular Weight (g/mol): 220.28 MDL Number: MFCD00005198 InChI Key: CPHGOBGXZQKCKI-UHFFFAOYSA-N Synonym: 4,5-diphenylimidazole,diphenylimidazole,1h-imidazole, 4,5-diphenyl,imidazole, 4,5-diphenyl,dsstox_cid_25700,dsstox_rid_81072,dsstox_gsid_45700,4,5-diphenyl-1h-imidazol,imidazole,5-diphenyl,4,5-diphenylglyoxaline PubChem CID: 69588 IUPAC Name: 4,5-diphenyl-1H-imidazole SMILES: N1C=NC(=C1C1=CC=CC=C1)C1=CC=CC=C1

PubChem CID 69588
CAS 668-94-0
Molecular Weight (g/mol) 220.28
MDL Number MFCD00005198
SMILES N1C=NC(=C1C1=CC=CC=C1)C1=CC=CC=C1
Synonym 4,5-diphenylimidazole,diphenylimidazole,1h-imidazole, 4,5-diphenyl,imidazole, 4,5-diphenyl,dsstox_cid_25700,dsstox_rid_81072,dsstox_gsid_45700,4,5-diphenyl-1h-imidazol,imidazole,5-diphenyl,4,5-diphenylglyoxaline
IUPAC Name 4,5-diphenyl-1H-imidazole
InChI Key CPHGOBGXZQKCKI-UHFFFAOYSA-N
Molecular Formula C15H12N2
973

1-Butyl-3-methylimidazolium Methanesulfonate 98.0+%, TCI America™

CAS: 342789-81-5 Molecular Formula: C9H18N2O3S Molecular Weight (g/mol): 234.314 MDL Number: MFCD06798173 InChI Key: PUHVBRXUKOGSBC-UHFFFAOYSA-M Synonym: 1-butyl-3-methylimidazolium methanesulfonate,1-butyl-3-methylimidazolium mesylate,acmc-20aowi,c4mim mesylate,basionics™ st 78,dsstox_cid_27888,dsstox_rid_82641,dsstox_gsid_47912,1-butyl-3-methylimidazolium methylsulfonate,1-n-butyl-3-methylimidazolium methanesulfonate PubChem CID: 11492381 IUPAC Name: 1-butyl-3-methylimidazol-3-ium;methanesulfonate SMILES: CCCCN1C=C[N+](=C1)C.CS(=O)(=O)[O-]

PubChem CID 11492381
CAS 342789-81-5
Molecular Weight (g/mol) 234.314
MDL Number MFCD06798173
SMILES CCCCN1C=C[N+](=C1)C.CS(=O)(=O)[O-]
Synonym 1-butyl-3-methylimidazolium methanesulfonate,1-butyl-3-methylimidazolium mesylate,acmc-20aowi,c4mim mesylate,basionics™ st 78,dsstox_cid_27888,dsstox_rid_82641,dsstox_gsid_47912,1-butyl-3-methylimidazolium methylsulfonate,1-n-butyl-3-methylimidazolium methanesulfonate
IUPAC Name 1-butyl-3-methylimidazol-3-ium;methanesulfonate
InChI Key PUHVBRXUKOGSBC-UHFFFAOYSA-M
Molecular Formula C9H18N2O3S
974

Etomidate 98.0+%, TCI America™

CAS: 33125-97-2 Molecular Formula: C14H16N2O2 Molecular Weight (g/mol): 244.294 MDL Number: MFCD00869295 InChI Key: NPUKDXXFDDZOKR-NSHDSACASA-N Synonym: etomidate,+-etomidate,d-etomidate,etomidato,etomidatum,amidate,hypnomidate,r-ethyl 1-1-phenylethyl-1h-imidazole-5-carboxylate,etomidatum inn-latin PubChem CID: 6338045 IUPAC Name: ethyl 3-[(1S)-1-phenylethyl]imidazole-4-carboxylate SMILES: CCOC(=O)C1=CN=CN1C(C)C2=CC=CC=C2

PubChem CID 6338045
CAS 33125-97-2
Molecular Weight (g/mol) 244.294
MDL Number MFCD00869295
SMILES CCOC(=O)C1=CN=CN1C(C)C2=CC=CC=C2
Synonym etomidate,+-etomidate,d-etomidate,etomidato,etomidatum,amidate,hypnomidate,r-ethyl 1-1-phenylethyl-1h-imidazole-5-carboxylate,etomidatum inn-latin
IUPAC Name ethyl 3-[(1S)-1-phenylethyl]imidazole-4-carboxylate
InChI Key NPUKDXXFDDZOKR-NSHDSACASA-N
Molecular Formula C14H16N2O2
975

1-Ethyl-3-methylimidazolium Bis(trifluoromethanesulfonyl)imide 98.0+%, TCI America™

CAS: 174899-82-2 Molecular Formula: C8H11F6N3O4S2 Molecular Weight (g/mol): 391.303 MDL Number: MFCD03788927 InChI Key: LRESCJAINPKJTO-UHFFFAOYSA-N PubChem CID: 11731903 IUPAC Name: bis(trifluoromethylsulfonyl)azanide;1-ethyl-3-methylimidazol-3-ium SMILES: CCN1C=C[N+](=C1)C.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F

PubChem CID 11731903
CAS 174899-82-2
Molecular Weight (g/mol) 391.303
MDL Number MFCD03788927
SMILES CCN1C=C[N+](=C1)C.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F
IUPAC Name bis(trifluoromethylsulfonyl)azanide;1-ethyl-3-methylimidazol-3-ium
InChI Key LRESCJAINPKJTO-UHFFFAOYSA-N
Molecular Formula C8H11F6N3O4S2