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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.
Thiazoles (7,176)
Imidazoles (5,827)
Pyrazoles (2,022)
Oxazoles (1,557)
Triazoles (660)
Oxadiazoles (456)
Isoxazoles (262)
Thiadiazoles (88)
Dithiazoles (4)

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226 – 240 of 16,834 results
226
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1H-Indazole-6-carboxaldehyde, 97%

CAS: 669050-69-5 Molecular Formula: C8H6N2O Molecular Weight (g/mol): 146.15 InChI Key: JTWYTTXTJFDYAG-UHFFFAOYSA-N Synonym: 1h-indazole-6-carboxaldehyde,6-formylindazole,6-formyl-1h-indazole,2h-indazole-6-carbaldehyde,indazole-6-carboxaldehyde,1h-indazole-6-cabaldehyde,pubchem23878,acmc-1bc45,2h-indazole-6-carboxaldehyde,1-h-indazole-6-carboxaldehyde PubChem CID: 18538368 IUPAC Name: 1H-indazole-6-carbaldehyde SMILES: C1=CC2=C(C=C1C=O)NN=C2

PubChem CID 18538368
CAS 669050-69-5
Molecular Weight (g/mol) 146.15
SMILES C1=CC2=C(C=C1C=O)NN=C2
Synonym 1h-indazole-6-carboxaldehyde,6-formylindazole,6-formyl-1h-indazole,2h-indazole-6-carbaldehyde,indazole-6-carboxaldehyde,1h-indazole-6-cabaldehyde,pubchem23878,acmc-1bc45,2h-indazole-6-carboxaldehyde,1-h-indazole-6-carboxaldehyde
IUPAC Name 1H-indazole-6-carbaldehyde
InChI Key JTWYTTXTJFDYAG-UHFFFAOYSA-N
Molecular Formula C8H6N2O
227

1-methyl-1h-pyrazole-4-carbonyl chloride, 97%, Thermo Scientific™

CAS: 79583-19-0 Molecular Formula: C5H5ClN2O Molecular Weight (g/mol): 144.558 MDL Number: MFCD03421496 InChI Key: QLBBQLJPRXPVOS-UHFFFAOYSA-N Synonym: 1-methyl-1h-pyrazole-4-carbonyl chloride,1h-pyrazole-4-carbonyl chloride, 1-methyl,1h-pyrazole-4-carbonylchloride, 1-methyl,1-methyl-1h-pyrazole-4-carboxylic acid chloride,1h-pyrazole-4-carbonyl chloride, 1-methyl-9ci PubChem CID: 3164931 IUPAC Name: 1-methylpyrazole-4-carbonyl chloride SMILES: CN1C=C(C=N1)C(=O)Cl

PubChem CID 3164931
CAS 79583-19-0
Molecular Weight (g/mol) 144.558
MDL Number MFCD03421496
SMILES CN1C=C(C=N1)C(=O)Cl
Synonym 1-methyl-1h-pyrazole-4-carbonyl chloride,1h-pyrazole-4-carbonyl chloride, 1-methyl,1h-pyrazole-4-carbonylchloride, 1-methyl,1-methyl-1h-pyrazole-4-carboxylic acid chloride,1h-pyrazole-4-carbonyl chloride, 1-methyl-9ci
IUPAC Name 1-methylpyrazole-4-carbonyl chloride
InChI Key QLBBQLJPRXPVOS-UHFFFAOYSA-N
Molecular Formula C5H5ClN2O
228
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5-Amino-1,3-dimethyl-1H-pyrazole, 98%

CAS: 3524-32-1 Molecular Formula: C5H9N3 Molecular Weight (g/mol): 111.148 MDL Number: MFCD00051651 InChI Key: ZFDGMMZLXSFNFU-UHFFFAOYSA-N Synonym: 5-amino-1,3-dimethylpyrazole,1,3-dimethyl-1h-pyrazol-5-amine,1,3-dimethyl-1h-pyrazole-5yl-amine,1h-pyrazol-5-amine, 1,3-dimethyl,3-amino-2,5-dimethyl-2h-pyrazole,2,5-dimethyl-2h-pyrazol-3-ylamine,5-amino-1,3-dimethyl pyrazole,1,3-dimethyl-1h-pyrazole-5-amine,5-amino-1,3-dimethyl-1h-pyrazole,1,3-dimethyl-5-aminopyrazole PubChem CID: 520721 IUPAC Name: 2,5-dimethylpyrazol-3-amine SMILES: CC1=NN(C(=C1)N)C

PubChem CID 520721
CAS 3524-32-1
Molecular Weight (g/mol) 111.148
MDL Number MFCD00051651
SMILES CC1=NN(C(=C1)N)C
Synonym 5-amino-1,3-dimethylpyrazole,1,3-dimethyl-1h-pyrazol-5-amine,1,3-dimethyl-1h-pyrazole-5yl-amine,1h-pyrazol-5-amine, 1,3-dimethyl,3-amino-2,5-dimethyl-2h-pyrazole,2,5-dimethyl-2h-pyrazol-3-ylamine,5-amino-1,3-dimethyl pyrazole,1,3-dimethyl-1h-pyrazole-5-amine,5-amino-1,3-dimethyl-1h-pyrazole,1,3-dimethyl-5-aminopyrazole
IUPAC Name 2,5-dimethylpyrazol-3-amine
InChI Key ZFDGMMZLXSFNFU-UHFFFAOYSA-N
Molecular Formula C5H9N3
229
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3,5-Dimethyl-1H-pyrazole-4-sulfonyl chloride, 97%

CAS: 80466-78-0 Molecular Formula: C5H7ClN2O2S Molecular Weight (g/mol): 194.63 MDL Number: MFCD04969910 InChI Key: NBGSZCQLPLYKJH-UHFFFAOYSA-N Synonym: 1h-pyrazole-4-sulfonylchloride, 3,5-dimethyl,3,5-dimethylpyrazol-4-yl chlorosulfone,1h-pyrazole-4-sulfonyl chloride, 3,5-dimethyl,pyrazole, 4-chlorosulfonyl-3,5-dimethyl,3,5-dimethyl-1h-pyrazole-4-sulfonylchloride,# PubChem CID: 594587 IUPAC Name: 3,5-dimethyl-1H-pyrazole-4-sulfonyl chloride SMILES: CC1=C(C(C)=NN1)S(Cl)(=O)=O

PubChem CID 594587
CAS 80466-78-0
Molecular Weight (g/mol) 194.63
MDL Number MFCD04969910
SMILES CC1=C(C(C)=NN1)S(Cl)(=O)=O
Synonym 1h-pyrazole-4-sulfonylchloride, 3,5-dimethyl,3,5-dimethylpyrazol-4-yl chlorosulfone,1h-pyrazole-4-sulfonyl chloride, 3,5-dimethyl,pyrazole, 4-chlorosulfonyl-3,5-dimethyl,3,5-dimethyl-1h-pyrazole-4-sulfonylchloride,#
IUPAC Name 3,5-dimethyl-1H-pyrazole-4-sulfonyl chloride
InChI Key NBGSZCQLPLYKJH-UHFFFAOYSA-N
Molecular Formula C5H7ClN2O2S
230
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5-(Chloromethyl)-1,3-dimethyl-1H-pyrazole, 97%, Thermo Scientific Chemicals

CAS: 852227-86-2 Molecular Formula: C6H9ClN2 Molecular Weight (g/mol): 144.60 MDL Number: MFCD07368502 InChI Key: SGEZKPNUNBVVLB-UHFFFAOYSA-N PubChem CID: 4961270 IUPAC Name: 5-(chloromethyl)-1,3-dimethylpyrazole SMILES: CN1N=C(C)C=C1CCl

PubChem CID 4961270
CAS 852227-86-2
Molecular Weight (g/mol) 144.60
MDL Number MFCD07368502
SMILES CN1N=C(C)C=C1CCl
IUPAC Name 5-(chloromethyl)-1,3-dimethylpyrazole
InChI Key SGEZKPNUNBVVLB-UHFFFAOYSA-N
Molecular Formula C6H9ClN2
231

3-Bromo-7-nitroindazole, 98+%

CAS: 74209-34-0 Molecular Formula: C7H4BrN3O2 Molecular Weight (g/mol): 242.03 MDL Number: MFCD00159910 InChI Key: NFSTZPMYAZRZPC-UHFFFAOYSA-N Synonym: 3-bromo-7-nitroindazole,3-bromo-7-nitro-1h-indazole,1h-indazole,3-bromo-7-nitro,brni,3-bromo-7ni,3-br-7-nitroindazole,tocris-0735,lopac-b-2050,d0u6zt,d0x5qj PubChem CID: 1649 IUPAC Name: 3-bromo-7-nitro-2H-indazole SMILES: [O-][N+](=O)C1=CC=CC2=C(Br)NN=C12

PubChem CID 1649
CAS 74209-34-0
Molecular Weight (g/mol) 242.03
MDL Number MFCD00159910
SMILES [O-][N+](=O)C1=CC=CC2=C(Br)NN=C12
Synonym 3-bromo-7-nitroindazole,3-bromo-7-nitro-1h-indazole,1h-indazole,3-bromo-7-nitro,brni,3-bromo-7ni,3-br-7-nitroindazole,tocris-0735,lopac-b-2050,d0u6zt,d0x5qj
IUPAC Name 3-bromo-7-nitro-2H-indazole
InChI Key NFSTZPMYAZRZPC-UHFFFAOYSA-N
Molecular Formula C7H4BrN3O2
232
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Tetrakis(1-pyrazolyl)borate, potassium salt, 95%

CAS: 14782-58-2 Molecular Formula: C12H12BKN8 Molecular Weight (g/mol): 318.2 MDL Number: MFCD00800557 InChI Key: RKBGLZQVHBLUBM-UHFFFAOYSA-N Synonym: tetrakis 1-pyrazolyl borate,potassium tetrakis pyrazol-1-yloxy boranuide PubChem CID: 92043288 IUPAC Name: potassium;tetra(pyrazol-1-yloxy)boranuide SMILES: [B-](ON1C=CC=N1)(ON2C=CC=N2)(ON3C=CC=N3)ON4C=CC=N4.[K+]

PubChem CID 92043288
CAS 14782-58-2
Molecular Weight (g/mol) 318.2
MDL Number MFCD00800557
SMILES [B-](ON1C=CC=N1)(ON2C=CC=N2)(ON3C=CC=N3)ON4C=CC=N4.[K+]
Synonym tetrakis 1-pyrazolyl borate,potassium tetrakis pyrazol-1-yloxy boranuide
IUPAC Name potassium;tetra(pyrazol-1-yloxy)boranuide
InChI Key RKBGLZQVHBLUBM-UHFFFAOYSA-N
Molecular Formula C12H12BKN8
233
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3-Indazolinone, 97%

CAS: 7364-25-2 Molecular Formula: C7H6N2O Molecular Weight (g/mol): 134.138 MDL Number: MFCD00005685 InChI Key: SWEICGMKXPNXNU-UHFFFAOYSA-N Synonym: 1h-indazol-3-ol,3-indazolinone,indazolinone,1h-indazol-3 2h-one,3-hydroxy-1h-indazole,3-hydroxyindazole,1,2-dihydro-3h-indazol-3-one,3-oxo-1,2-indazole,3h-indazol-3-one, 1,2-dihydro,2h-indazol-3-ol PubChem CID: 81829 IUPAC Name: 1,2-dihydroindazol-3-one SMILES: C1=CC=C2C(=C1)C(=O)NN2

PubChem CID 81829
CAS 7364-25-2
Molecular Weight (g/mol) 134.138
MDL Number MFCD00005685
SMILES C1=CC=C2C(=C1)C(=O)NN2
Synonym 1h-indazol-3-ol,3-indazolinone,indazolinone,1h-indazol-3 2h-one,3-hydroxy-1h-indazole,3-hydroxyindazole,1,2-dihydro-3h-indazol-3-one,3-oxo-1,2-indazole,3h-indazol-3-one, 1,2-dihydro,2h-indazol-3-ol
IUPAC Name 1,2-dihydroindazol-3-one
InChI Key SWEICGMKXPNXNU-UHFFFAOYSA-N
Molecular Formula C7H6N2O
234

1:3-Dimethyl-1H-pyrazole-5-carbothioamide, 97%, Thermo Scientific™

CAS: 844891-03-8 Molecular Formula: C6H9N3S Molecular Weight (g/mol): 155.219 InChI Key: RVWYPAZKPYVUDC-UHFFFAOYSA-N Synonym: 1,3-dimethyl-1h-pyrazole-5-carbothioamide,1h-pyrazole-5-carbothioamide,1,3-dimethyl,amino 1,3-dimethylpyrazol-5-yl methane-1-thione PubChem CID: 2795270 IUPAC Name: 2,5-dimethylpyrazole-3-carbothioamide SMILES: CC1=NN(C(=C1)C(=S)N)C

PubChem CID 2795270
CAS 844891-03-8
Molecular Weight (g/mol) 155.219
SMILES CC1=NN(C(=C1)C(=S)N)C
Synonym 1,3-dimethyl-1h-pyrazole-5-carbothioamide,1h-pyrazole-5-carbothioamide,1,3-dimethyl,amino 1,3-dimethylpyrazol-5-yl methane-1-thione
IUPAC Name 2,5-dimethylpyrazole-3-carbothioamide
InChI Key RVWYPAZKPYVUDC-UHFFFAOYSA-N
Molecular Formula C6H9N3S
235
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1-Butyl-2,3-dimethylimidazolium chloride, 99%

CAS: 98892-75-2 Molecular Formula: C9H17ClN2 Molecular Weight (g/mol): 188.699 MDL Number: MFCD03093291 InChI Key: HHHYPTORQNESCU-UHFFFAOYSA-M Synonym: 1-butyl-2,3-dimethylimidazolium chloride,1-butyl-2,3-dimethyl-1h-imidazol-3-ium chloride,1-butyl-2,3-dimethylimidazol-1-ium chloride,3-butyl-1,2-dimethylimidazol-1-ium chloride,acmc-209sba,dsstox_cid_27882,dsstox_rid_82635,dsstox_gsid_47906,1-butyl-2,3-dimethylimidazoliumchloride,1-butyl-2,3-dime-thylimidazolium chloride PubChem CID: 2734167 IUPAC Name: 1-butyl-2,3-dimethylimidazol-3-ium;chloride SMILES: CCCCN1C=C[N+](=C1C)C.[Cl-]

PubChem CID 2734167
CAS 98892-75-2
Molecular Weight (g/mol) 188.699
MDL Number MFCD03093291
SMILES CCCCN1C=C[N+](=C1C)C.[Cl-]
Synonym 1-butyl-2,3-dimethylimidazolium chloride,1-butyl-2,3-dimethyl-1h-imidazol-3-ium chloride,1-butyl-2,3-dimethylimidazol-1-ium chloride,3-butyl-1,2-dimethylimidazol-1-ium chloride,acmc-209sba,dsstox_cid_27882,dsstox_rid_82635,dsstox_gsid_47906,1-butyl-2,3-dimethylimidazoliumchloride,1-butyl-2,3-dime-thylimidazolium chloride
IUPAC Name 1-butyl-2,3-dimethylimidazol-3-ium;chloride
InChI Key HHHYPTORQNESCU-UHFFFAOYSA-M
Molecular Formula C9H17ClN2
236

2-Phenyl-1,3-thiazole-4-carbaldehyde, ≥90%, Thermo Scientific™

CAS: 20949-81-9 Molecular Formula: C10H7NOS Molecular Weight (g/mol): 189.232 MDL Number: MFCD02681934 InChI Key: OLLKCCGWRITPOV-UHFFFAOYSA-N PubChem CID: 736524 IUPAC Name: 2-phenyl-1,3-thiazole-4-carbaldehyde SMILES: C1=CC=C(C=C1)C2=NC(=CS2)C=O

PubChem CID 736524
CAS 20949-81-9
Molecular Weight (g/mol) 189.232
MDL Number MFCD02681934
SMILES C1=CC=C(C=C1)C2=NC(=CS2)C=O
IUPAC Name 2-phenyl-1,3-thiazole-4-carbaldehyde
InChI Key OLLKCCGWRITPOV-UHFFFAOYSA-N
Molecular Formula C10H7NOS
237

N,2-Dimethyl-(1,3-thiazol-4-yl)methylamine, 97%, Thermo Scientific™

CAS: 144163-81-5 Molecular Formula: C6H10N2S Molecular Weight (g/mol): 142.22 MDL Number: MFCD06738964 InChI Key: GJHOBSIOQKGKSG-UHFFFAOYSA-N Synonym: methyl-2-methyl-thiazol-4-ylmethyl-amine,methyl-2-methylthiazole-4-yl methyl amine,n-methyl-1-2-methylthiazol-4-yl methanamine,methyl 2-methyl-1,3-thiazol-4-yl methyl amine,4-thiazolemethanamine,n,2-dimethyl,n-methyl 2-methylthiazol-4-yl methanamine,4-thiazolemethanamine, n,2-dimethyl,n-methyl-1-2-methyl-1,3-thiazol-4-yl methanamine,n,2-dimethyl-1,3-thiazol-4-yl methylamine,2-methyl-4-methyl aminomethyl-1,3-thiazole PubChem CID: 18939489 IUPAC Name: N-methyl-1-(2-methyl-1,3-thiazol-4-yl)methanamine SMILES: CC1=NC(=CS1)CNC

PubChem CID 18939489
CAS 144163-81-5
Molecular Weight (g/mol) 142.22
MDL Number MFCD06738964
SMILES CC1=NC(=CS1)CNC
Synonym methyl-2-methyl-thiazol-4-ylmethyl-amine,methyl-2-methylthiazole-4-yl methyl amine,n-methyl-1-2-methylthiazol-4-yl methanamine,methyl 2-methyl-1,3-thiazol-4-yl methyl amine,4-thiazolemethanamine,n,2-dimethyl,n-methyl 2-methylthiazol-4-yl methanamine,4-thiazolemethanamine, n,2-dimethyl,n-methyl-1-2-methyl-1,3-thiazol-4-yl methanamine,n,2-dimethyl-1,3-thiazol-4-yl methylamine,2-methyl-4-methyl aminomethyl-1,3-thiazole
IUPAC Name N-methyl-1-(2-methyl-1,3-thiazol-4-yl)methanamine
InChI Key GJHOBSIOQKGKSG-UHFFFAOYSA-N
Molecular Formula C6H10N2S
238

1,3-Thiazole-2-carboxylic acid, 95%, Thermo Scientific™

CAS: 14190-59-1 Molecular Formula: C4H3NO2S Molecular Weight (g/mol): 129.133 MDL Number: MFCD02094169 InChI Key: IJVLVRYLIMQVDD-UHFFFAOYSA-N Synonym: thiazole-2-carboxylic acid,2-thiazolecarboxylic acid,thiazole-2-carboxylicacid,2-carboxy-1,3-thiazole,thiazolecarboxylic acid,pubchem16257,thiazole carboxylic acid,2-carboxythiazole,acmc-209cn5 PubChem CID: 2762733 IUPAC Name: 1,3-thiazole-2-carboxylic acid SMILES: C1=CSC(=N1)C(=O)O

PubChem CID 2762733
CAS 14190-59-1
Molecular Weight (g/mol) 129.133
MDL Number MFCD02094169
SMILES C1=CSC(=N1)C(=O)O
Synonym thiazole-2-carboxylic acid,2-thiazolecarboxylic acid,thiazole-2-carboxylicacid,2-carboxy-1,3-thiazole,thiazolecarboxylic acid,pubchem16257,thiazole carboxylic acid,2-carboxythiazole,acmc-209cn5
IUPAC Name 1,3-thiazole-2-carboxylic acid
InChI Key IJVLVRYLIMQVDD-UHFFFAOYSA-N
Molecular Formula C4H3NO2S
239

5-(2-Methyl-1,3-thiazol-4-yl)-3-isoxazolecarboxylic acid, 97%, Thermo Scientific™

CAS: 368870-05-7 Molecular Formula: C8H6N2O3S Molecular Weight (g/mol): 210.207 MDL Number: MFCD03086107 InChI Key: QAXQRHWAJNDTCV-UHFFFAOYSA-N Synonym: 5-2-methyl-1,3-thiazol-4-yl-3-isoxazolecarboxylic acid,5-2-methyl-1,3-thiazol-4-yl-1,2-oxazole-3-carboxylic acid,3-isoxazolecarboxylicacid, 5-2-methyl-4-thiazolyl,5-2-methyl-1,3-thiazol-4-yl-3-isoxazolecarboxyli,5-2-methylthiazol-4-yl isoxazole-3-carboxylic acid,3-carboxy-5-2-methyl-1,3-thiazol-4-yl-1,2-oxazole,4-3-carboxy-1,2-oxazol-5-yl-2-methyl-1,3-thiazole,5-2-methyl-1,3-thiazol-4-yl isoxazole-3-carboxylic acid PubChem CID: 2776408 IUPAC Name: 5-(2-methyl-1,3-thiazol-4-yl)-1,2-oxazole-3-carboxylic acid SMILES: CC1=NC(=CS1)C2=CC(=NO2)C(=O)O

PubChem CID 2776408
CAS 368870-05-7
Molecular Weight (g/mol) 210.207
MDL Number MFCD03086107
SMILES CC1=NC(=CS1)C2=CC(=NO2)C(=O)O
Synonym 5-2-methyl-1,3-thiazol-4-yl-3-isoxazolecarboxylic acid,5-2-methyl-1,3-thiazol-4-yl-1,2-oxazole-3-carboxylic acid,3-isoxazolecarboxylicacid, 5-2-methyl-4-thiazolyl,5-2-methyl-1,3-thiazol-4-yl-3-isoxazolecarboxyli,5-2-methylthiazol-4-yl isoxazole-3-carboxylic acid,3-carboxy-5-2-methyl-1,3-thiazol-4-yl-1,2-oxazole,4-3-carboxy-1,2-oxazol-5-yl-2-methyl-1,3-thiazole,5-2-methyl-1,3-thiazol-4-yl isoxazole-3-carboxylic acid
IUPAC Name 5-(2-methyl-1,3-thiazol-4-yl)-1,2-oxazole-3-carboxylic acid
InChI Key QAXQRHWAJNDTCV-UHFFFAOYSA-N
Molecular Formula C8H6N2O3S
240

4-Methyl-2-pyrid-4-yl-1,3-thiazole-5-carbonyl chloride hydrochloride, 90%, Thermo Scientific™

CAS: 953408-88-3 Molecular Formula: C10H8Cl2N2OS Molecular Weight (g/mol): 275.147 MDL Number: MFCD09879910 InChI Key: XERFFSPGBNKEDT-UHFFFAOYSA-N Synonym: 4-methyl-2-pyrid-4-yl-1,3-thiazole-5-carbonyl chloride hydrochloride,4-methyl-2-pyridin-4-yl-1,3-thiazole-5-carbonyl chloride hydrochloride,4-methyl-2-pyridin-4-yl-1,3-thiazole-5-carbonyl chloride-hydrogen chloride 1/1,5-thiazolecarbonylchloride, 4-methyl-2-4-pyridinyl-, hydrochloride 1:1 PubChem CID: 24229588 IUPAC Name: 4-methyl-2-pyridin-4-yl-1,3-thiazole-5-carbonyl chloride;hydrochloride SMILES: CC1=C(SC(=N1)C2=CC=NC=C2)C(=O)Cl.Cl

PubChem CID 24229588
CAS 953408-88-3
Molecular Weight (g/mol) 275.147
MDL Number MFCD09879910
SMILES CC1=C(SC(=N1)C2=CC=NC=C2)C(=O)Cl.Cl
Synonym 4-methyl-2-pyrid-4-yl-1,3-thiazole-5-carbonyl chloride hydrochloride,4-methyl-2-pyridin-4-yl-1,3-thiazole-5-carbonyl chloride hydrochloride,4-methyl-2-pyridin-4-yl-1,3-thiazole-5-carbonyl chloride-hydrogen chloride 1/1,5-thiazolecarbonylchloride, 4-methyl-2-4-pyridinyl-, hydrochloride 1:1
IUPAC Name 4-methyl-2-pyridin-4-yl-1,3-thiazole-5-carbonyl chloride;hydrochloride
InChI Key XERFFSPGBNKEDT-UHFFFAOYSA-N
Molecular Formula C10H8Cl2N2OS