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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)
Oxazoles (556)
Oxadiazoles (242)
Isoxazoles (232)
Thiadiazoles (71)
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1,006 – 1,020 of 6,965 results
1,006

3-Methylisoxazole-5-carboxylic Acid 98.0+%, TCI America™

CAS: 4857-42-5 Molecular Formula: C5H5NO3 Molecular Weight (g/mol): 127.099 MDL Number: MFCD00464222 InChI Key: HXIYCKAAQPHZBM-UHFFFAOYSA-N Synonym: 3-methylisoxazole-5-carboxylic acid,3-methyl-5-isoxazolecarboxylic acid,5-isoxazolecarboxylic acid, 3-methyl,3-methyl-isoxazole-5-carboxylic acid,5-carboxy-3-methylisoxazole,5-isoxazolecarboxylicacid, 3-methyl,3-methylisoxazole-5-carboxylicacid,acmc-1aruu,3-methyl-5-carboxyisoxazole,aronis24519 PubChem CID: 853085 IUPAC Name: 3-methyl-1,2-oxazole-5-carboxylic acid SMILES: CC1=NOC(=C1)C(=O)O

PubChem CID 853085
CAS 4857-42-5
Molecular Weight (g/mol) 127.099
MDL Number MFCD00464222
SMILES CC1=NOC(=C1)C(=O)O
Synonym 3-methylisoxazole-5-carboxylic acid,3-methyl-5-isoxazolecarboxylic acid,5-isoxazolecarboxylic acid, 3-methyl,3-methyl-isoxazole-5-carboxylic acid,5-carboxy-3-methylisoxazole,5-isoxazolecarboxylicacid, 3-methyl,3-methylisoxazole-5-carboxylicacid,acmc-1aruu,3-methyl-5-carboxyisoxazole,aronis24519
IUPAC Name 3-methyl-1,2-oxazole-5-carboxylic acid
InChI Key HXIYCKAAQPHZBM-UHFFFAOYSA-N
Molecular Formula C5H5NO3
1,007

3,5-Diisopropylpyrazole 98.0+%, TCI America™

CAS: 17536-00-4 Molecular Formula: C9H16N2 Molecular Weight (g/mol): 152.241 MDL Number: MFCD00671516 InChI Key: PJSJVTZSFIRYIZ-UHFFFAOYSA-N PubChem CID: 5255229 IUPAC Name: 3,5-di(propan-2-yl)-1H-pyrazole SMILES: CC(C)C1=CC(=NN1)C(C)C

PubChem CID 5255229
CAS 17536-00-4
Molecular Weight (g/mol) 152.241
MDL Number MFCD00671516
SMILES CC(C)C1=CC(=NN1)C(C)C
IUPAC Name 3,5-di(propan-2-yl)-1H-pyrazole
InChI Key PJSJVTZSFIRYIZ-UHFFFAOYSA-N
Molecular Formula C9H16N2
1,008

1-Amidinopyrazole Hydrochloride 98.0+%, TCI America™

CAS: 4023-02-3 Molecular Formula: C4H6N4 Molecular Weight (g/mol): 110.12 MDL Number: MFCD00210087 InChI Key: UCQFSGCWHRTMGG-UHFFFAOYSA-N Synonym: 1h-pyrazole-1-carboxamidine hydrochloride,1h-pyrazole-1-carboximidamide hydrochloride,1-amidinopyrazole hydrochloride,praxadine,pyrazole-1-carboxamidine hydrochloride,pyrazole-1-carboximidamide hydrochloride,pyrazole-1-carboxamidine hcl,1h-pyrazole-1-carboxamidinehydrochloride,praxadine hydrochloride,1h-pyrazole-1-carboxamidine hcl PubChem CID: 2734672 IUPAC Name: pyrazole-1-carboximidamide;hydrochloride SMILES: C1=CN(N=C1)C(=N)N.Cl

PubChem CID 2734672
CAS 4023-02-3
Molecular Weight (g/mol) 110.12
MDL Number MFCD00210087
SMILES C1=CN(N=C1)C(=N)N.Cl
Synonym 1h-pyrazole-1-carboxamidine hydrochloride,1h-pyrazole-1-carboximidamide hydrochloride,1-amidinopyrazole hydrochloride,praxadine,pyrazole-1-carboxamidine hydrochloride,pyrazole-1-carboximidamide hydrochloride,pyrazole-1-carboxamidine hcl,1h-pyrazole-1-carboxamidinehydrochloride,praxadine hydrochloride,1h-pyrazole-1-carboxamidine hcl
IUPAC Name pyrazole-1-carboximidamide;hydrochloride
InChI Key UCQFSGCWHRTMGG-UHFFFAOYSA-N
Molecular Formula C4H6N4
1,009

N,N'-Bis(carbobenzoxy)-1H-pyrazole-1-carboxamidine 98.0+%, TCI America™

CAS: 152120-55-3 Molecular Formula: C20H18N4O4 Molecular Weight (g/mol): 378.388 MDL Number: MFCD02683516 InChI Key: NRBUVVTTYMTSKM-UHFFFAOYSA-N Synonym: n,n'-bis-z-1-guanylpyrazole,n,n'-bis benzyloxycarbonyl-1h-pyrazole-1-carboxamidine,n,n-bisbenzyloxycarbonyl-1-guanylpyrazole,benzyl benzyloxy carbonyl amino 1h-pyrazol-1-yl methylene carbamate,pyrazole z 2,pyrazol z 2,n,n'-bs-z-1-guanylpyrazole,n,n;-bis-z-1-guanylpyrazole,benzyl n-1z-benzyloxy carbonyl imino pyrazol-1-yl methyl carbamate,n,n'-di-cbz-1h-pyrazole-1-carbo PubChem CID: 6371643 IUPAC Name: benzyl (NZ)-N-[phenylmethoxycarbonylamino(pyrazol-1-yl)methylidene]carbamate SMILES: C1=CC=C(C=C1)COC(=O)NC(=NC(=O)OCC2=CC=CC=C2)N3C=CC=N3

PubChem CID 6371643
CAS 152120-55-3
Molecular Weight (g/mol) 378.388
MDL Number MFCD02683516
SMILES C1=CC=C(C=C1)COC(=O)NC(=NC(=O)OCC2=CC=CC=C2)N3C=CC=N3
Synonym n,n'-bis-z-1-guanylpyrazole,n,n'-bis benzyloxycarbonyl-1h-pyrazole-1-carboxamidine,n,n-bisbenzyloxycarbonyl-1-guanylpyrazole,benzyl benzyloxy carbonyl amino 1h-pyrazol-1-yl methylene carbamate,pyrazole z 2,pyrazol z 2,n,n'-bs-z-1-guanylpyrazole,n,n;-bis-z-1-guanylpyrazole,benzyl n-1z-benzyloxy carbonyl imino pyrazol-1-yl methyl carbamate,n,n'-di-cbz-1h-pyrazole-1-carbo
IUPAC Name benzyl (NZ)-N-[phenylmethoxycarbonylamino(pyrazol-1-yl)methylidene]carbamate
InChI Key NRBUVVTTYMTSKM-UHFFFAOYSA-N
Molecular Formula C20H18N4O4
1,010

4-Bromoindazole 98.0+%, TCI America™

CAS: 186407-74-9 Molecular Formula: C7H5BrN2 Molecular Weight (g/mol): 197.035 MDL Number: MFCD05664001 InChI Key: KJIODOACRIRBPB-UHFFFAOYSA-N Synonym: 4-bromoindazole,1h-indazole, 4-bromo,4-bromo 1h indazole,4-bromo-indazole,bromo-1h-indazole,pubchem7834,4-bromo-2h-indazole,acmc-1bzds,4-bromanyl-1h-indazole PubChem CID: 22352548 IUPAC Name: 4-bromo-1H-indazole SMILES: C1=CC2=C(C=NN2)C(=C1)Br

PubChem CID 22352548
CAS 186407-74-9
Molecular Weight (g/mol) 197.035
MDL Number MFCD05664001
SMILES C1=CC2=C(C=NN2)C(=C1)Br
Synonym 4-bromoindazole,1h-indazole, 4-bromo,4-bromo 1h indazole,4-bromo-indazole,bromo-1h-indazole,pubchem7834,4-bromo-2h-indazole,acmc-1bzds,4-bromanyl-1h-indazole
IUPAC Name 4-bromo-1H-indazole
InChI Key KJIODOACRIRBPB-UHFFFAOYSA-N
Molecular Formula C7H5BrN2
1,011

1-Benzyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole 98.0+%, TCI America™

CAS: 761446-45-1 Molecular Formula: C16H21BN2O2 Molecular Weight (g/mol): 284.166 MDL Number: MFCD03789252 InChI Key: ZVPORPUUZXIPEF-UHFFFAOYSA-N Synonym: 1-benzyl-1h-pyrazole-4-boronic acid pinacol ester,1-phenylmethyl-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-1h-pyrazole,1-benzyl-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-1h-pyrazole,1-benzylpyrazole-4-boronic acid pinacol ester,1-benzyl-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyrazole,1-benzyl-4-1h-pyrazoleboronic acid, pinacol ester,1-benzyl-1h-pyrazole-4-boronic acid, pinacol ester,1-benzyl-1h-pyrazol-4-ylboronic acid, pinacol ester,1-benzyl-4-pyrazoleboronic acid pinacol ester,1-benzyl-4-tetramethyl-1,3,2-dioxaborolan-2-yl pyrazole PubChem CID: 2734771 IUPAC Name: 1-benzyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CN(N=C2)CC3=CC=CC=C3

PubChem CID 2734771
CAS 761446-45-1
Molecular Weight (g/mol) 284.166
MDL Number MFCD03789252
SMILES B1(OC(C(O1)(C)C)(C)C)C2=CN(N=C2)CC3=CC=CC=C3
Synonym 1-benzyl-1h-pyrazole-4-boronic acid pinacol ester,1-phenylmethyl-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-1h-pyrazole,1-benzyl-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-1h-pyrazole,1-benzylpyrazole-4-boronic acid pinacol ester,1-benzyl-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyrazole,1-benzyl-4-1h-pyrazoleboronic acid, pinacol ester,1-benzyl-1h-pyrazole-4-boronic acid, pinacol ester,1-benzyl-1h-pyrazol-4-ylboronic acid, pinacol ester,1-benzyl-4-pyrazoleboronic acid pinacol ester,1-benzyl-4-tetramethyl-1,3,2-dioxaborolan-2-yl pyrazole
IUPAC Name 1-benzyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole
InChI Key ZVPORPUUZXIPEF-UHFFFAOYSA-N
Molecular Formula C16H21BN2O2
1,012

3-Methyl-5-(trifluoromethyl)pyrazole 98.0+%, TCI America™

CAS: 10010-93-2 Molecular Formula: C5H5F3N2 Molecular Weight (g/mol): 150.104 MDL Number: MFCD00156058 InChI Key: DLCHCAYDSKIFIN-UHFFFAOYSA-N Synonym: 5-methyl-3-trifluoromethyl-1h-pyrazole,3-methyl-5-trifluoromethyl-1h-pyrazole,3-methyl-5-trifluoromethyl pyrazole,1h-pyrazole, 3-methyl-5-trifluoromethyl,5-methyl-3-trifluoromethyl pyrazole,3-trifluoromethyl-5-methyl pyrazole,pyrazole, 3-methyl-5-trifluoromethyl,3-methyl-5-trifluoromethylpyrazole,3-trifluoromethyl-5-methylpyrazole,3-methyl-5-trifluoromethyl-2h-pyrazole PubChem CID: 139077 IUPAC Name: 5-methyl-3-(trifluoromethyl)-1H-pyrazole SMILES: CC1=CC(=NN1)C(F)(F)F

PubChem CID 139077
CAS 10010-93-2
Molecular Weight (g/mol) 150.104
MDL Number MFCD00156058
SMILES CC1=CC(=NN1)C(F)(F)F
Synonym 5-methyl-3-trifluoromethyl-1h-pyrazole,3-methyl-5-trifluoromethyl-1h-pyrazole,3-methyl-5-trifluoromethyl pyrazole,1h-pyrazole, 3-methyl-5-trifluoromethyl,5-methyl-3-trifluoromethyl pyrazole,3-trifluoromethyl-5-methyl pyrazole,pyrazole, 3-methyl-5-trifluoromethyl,3-methyl-5-trifluoromethylpyrazole,3-trifluoromethyl-5-methylpyrazole,3-methyl-5-trifluoromethyl-2h-pyrazole
IUPAC Name 5-methyl-3-(trifluoromethyl)-1H-pyrazole
InChI Key DLCHCAYDSKIFIN-UHFFFAOYSA-N
Molecular Formula C5H5F3N2
1,013

5-Methylisoxazole-3-carboxylic Acid 98.0+%, TCI America™

CAS: 3405-77-4 Molecular Formula: C5H5NO3 Molecular Weight (g/mol): 127.099 MDL Number: MFCD01318162 InChI Key: BNMPIJWVMVNSRD-UHFFFAOYSA-N Synonym: 5-methylisoxazole-3-carboxylic acid,5-methylisoxazole-3-carboxylicacid,3-isoxazolecarboxylic acid, 5-methyl,5-methyl-3-isoxazolecarboxylic acid,5-methyl-isoxazole-3-carboxylic acid,3-carboxy-5-methylisoxazole,3-isoxazolecarboxylicacid, 5-methyl,isoxazole acid,pubchem15552,ksc224c5p PubChem CID: 76947 IUPAC Name: 5-methyl-1,2-oxazole-3-carboxylic acid SMILES: CC1=CC(=NO1)C(=O)O

PubChem CID 76947
CAS 3405-77-4
Molecular Weight (g/mol) 127.099
MDL Number MFCD01318162
SMILES CC1=CC(=NO1)C(=O)O
Synonym 5-methylisoxazole-3-carboxylic acid,5-methylisoxazole-3-carboxylicacid,3-isoxazolecarboxylic acid, 5-methyl,5-methyl-3-isoxazolecarboxylic acid,5-methyl-isoxazole-3-carboxylic acid,3-carboxy-5-methylisoxazole,3-isoxazolecarboxylicacid, 5-methyl,isoxazole acid,pubchem15552,ksc224c5p
IUPAC Name 5-methyl-1,2-oxazole-3-carboxylic acid
InChI Key BNMPIJWVMVNSRD-UHFFFAOYSA-N
Molecular Formula C5H5NO3
1,014

1-Nitropyrazole 97.0+%, TCI America™

CAS: 7119-95-1 Molecular Formula: C3H3N3O2 Molecular Weight (g/mol): 113.076 MDL Number: MFCD00015894 InChI Key: TYNVOQYGXDUHRX-UHFFFAOYSA-N PubChem CID: 146002 IUPAC Name: 1-nitropyrazole SMILES: C1=CN(N=C1)[N+](=O)[O-]

PubChem CID 146002
CAS 7119-95-1
Molecular Weight (g/mol) 113.076
MDL Number MFCD00015894
SMILES C1=CN(N=C1)[N+](=O)[O-]
IUPAC Name 1-nitropyrazole
InChI Key TYNVOQYGXDUHRX-UHFFFAOYSA-N
Molecular Formula C3H3N3O2
1,015

1-Methylpyrazole-5-methanol 98.0+%, TCI America™

CAS: 84547-61-5 Molecular Formula: C5H8N2O Molecular Weight (g/mol): 112.132 MDL Number: MFCD08556301 InChI Key: WQFOGLYQVFBDEY-UHFFFAOYSA-N Synonym: 1-methyl-1h-pyrazol-5-yl methanol,5-hydroxymethyl-1-methyl-1h-pyrazole,1h-pyrazole-5-methanol, 1-methyl,2-methylpyrazol-3-yl methanol,5-hydroxymethyl-1-methylpyrazole,1h-pyrazole-5-methanol,1-methyl,1-methylpyrazol-5-yl methan-1-ol,1-methylpyrazole-5-methanol,1-methyl-1h-pyrazol-5-yl ;methanol PubChem CID: 11815316 IUPAC Name: (2-methylpyrazol-3-yl)methanol SMILES: CN1C(=CC=N1)CO

PubChem CID 11815316
CAS 84547-61-5
Molecular Weight (g/mol) 112.132
MDL Number MFCD08556301
SMILES CN1C(=CC=N1)CO
Synonym 1-methyl-1h-pyrazol-5-yl methanol,5-hydroxymethyl-1-methyl-1h-pyrazole,1h-pyrazole-5-methanol, 1-methyl,2-methylpyrazol-3-yl methanol,5-hydroxymethyl-1-methylpyrazole,1h-pyrazole-5-methanol,1-methyl,1-methylpyrazol-5-yl methan-1-ol,1-methylpyrazole-5-methanol,1-methyl-1h-pyrazol-5-yl ;methanol
IUPAC Name (2-methylpyrazol-3-yl)methanol
InChI Key WQFOGLYQVFBDEY-UHFFFAOYSA-N
Molecular Formula C5H8N2O
1,016

6-Iodoindazole 98.0+%, TCI America™

CAS: 261953-36-0 Molecular Formula: C7H5IN2 Molecular Weight (g/mol): 244.035 MDL Number: MFCD04114695 InChI Key: RSGAXJZKQDNFEP-UHFFFAOYSA-N Synonym: 6-iodoindazole,1h-indazole, 6-iodo,6-iodo 1h indazole,6-iodo-indazole,pubchem18081,indazole, 6-iodo PubChem CID: 12991241 IUPAC Name: 6-iodo-1H-indazole SMILES: C1=CC2=C(C=C1I)NN=C2

PubChem CID 12991241
CAS 261953-36-0
Molecular Weight (g/mol) 244.035
MDL Number MFCD04114695
SMILES C1=CC2=C(C=C1I)NN=C2
Synonym 6-iodoindazole,1h-indazole, 6-iodo,6-iodo 1h indazole,6-iodo-indazole,pubchem18081,indazole, 6-iodo
IUPAC Name 6-iodo-1H-indazole
InChI Key RSGAXJZKQDNFEP-UHFFFAOYSA-N
Molecular Formula C7H5IN2
1,017

5-Bromoindazole 97.0+%, TCI America™

CAS: 53857-57-1 Molecular Formula: C7H5BrN2 Molecular Weight (g/mol): 197.04 MDL Number: MFCD00839493,MFCD26227374 InChI Key: STVHMYNPQCLUNJ-UHFFFAOYSA-N Synonym: 5-bromoindazole,5-bromo-2h-indazole,1h-indazole, 5-bromo,5-bromo-1hindazole,chembl16425,5-brom-1h-indazol,5-bromoazaindole,5-bromo indazole,5-bromo-indazole PubChem CID: 761929 IUPAC Name: 5-bromo-1H-indazole SMILES: BrC1=CC=C2NN=CC2=C1

PubChem CID 761929
CAS 53857-57-1
Molecular Weight (g/mol) 197.04
MDL Number MFCD00839493,MFCD26227374
SMILES BrC1=CC=C2NN=CC2=C1
Synonym 5-bromoindazole,5-bromo-2h-indazole,1h-indazole, 5-bromo,5-bromo-1hindazole,chembl16425,5-brom-1h-indazol,5-bromoazaindole,5-bromo indazole,5-bromo-indazole
IUPAC Name 5-bromo-1H-indazole
InChI Key STVHMYNPQCLUNJ-UHFFFAOYSA-N
Molecular Formula C7H5BrN2
1,018

3,5-Dimethyl-1-hydroxymethylpyrazole 98.0+%, TCI America™

CAS: 85264-33-1 Molecular Formula: C6H10N2O Molecular Weight (g/mol): 126.159 MDL Number: MFCD00020738 InChI Key: OBENDWOJIFFDLZ-UHFFFAOYSA-N Synonym: 3,5-dimethyl-1h-pyrazol-1-yl methanol,3,5-dimethylpyrazole-1-methanol,3,5-dimethyl-1h-pyrazole-1-methanol,3,5-dimethyl-1-hydroxymethylpyrazole,dimethyl hydroxymethyl pyrazole,1h-pyrazole-1-methanol, 3,5-dimethyl,3,5-dimethylpyrazole-1-carbinol,3,5-dimethyl pyrazole-1-carbinol,3,5-dimethylpyrazol-1-yl methanol,1-hydroxymethyl-3,5-dimethylpyrazole PubChem CID: 96393 IUPAC Name: (3,5-dimethylpyrazol-1-yl)methanol SMILES: CC1=CC(=NN1CO)C

PubChem CID 96393
CAS 85264-33-1
Molecular Weight (g/mol) 126.159
MDL Number MFCD00020738
SMILES CC1=CC(=NN1CO)C
Synonym 3,5-dimethyl-1h-pyrazol-1-yl methanol,3,5-dimethylpyrazole-1-methanol,3,5-dimethyl-1h-pyrazole-1-methanol,3,5-dimethyl-1-hydroxymethylpyrazole,dimethyl hydroxymethyl pyrazole,1h-pyrazole-1-methanol, 3,5-dimethyl,3,5-dimethylpyrazole-1-carbinol,3,5-dimethyl pyrazole-1-carbinol,3,5-dimethylpyrazol-1-yl methanol,1-hydroxymethyl-3,5-dimethylpyrazole
IUPAC Name (3,5-dimethylpyrazol-1-yl)methanol
InChI Key OBENDWOJIFFDLZ-UHFFFAOYSA-N
Molecular Formula C6H10N2O
1,019

1-Isopropylpyrazole 98.0+%, TCI America™

CAS: 18952-87-9 Molecular Formula: C6H10N2 Molecular Weight (g/mol): 110.16 MDL Number: MFCD07468920 InChI Key: ANMVTDVBEDVFRB-UHFFFAOYSA-N PubChem CID: 13469816 IUPAC Name: 1-(propan-2-yl)-1H-pyrazole SMILES: CC(C)N1C=CC=N1

PubChem CID 13469816
CAS 18952-87-9
Molecular Weight (g/mol) 110.16
MDL Number MFCD07468920
SMILES CC(C)N1C=CC=N1
IUPAC Name 1-(propan-2-yl)-1H-pyrazole
InChI Key ANMVTDVBEDVFRB-UHFFFAOYSA-N
Molecular Formula C6H10N2
1,020

Tris(3,5-dimethyl-1-pyrazolyl)methane 98.0+%, TCI America™

CAS: 28791-97-1 Molecular Formula: C16H22N6 Molecular Weight (g/mol): 298.39 MDL Number: MFCD00958749 InChI Key: COKUMKYWINNWLV-UHFFFAOYSA-N PubChem CID: 4359225 IUPAC Name: 1-[bis(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-3,5-dimethyl-1H-pyrazole SMILES: CC1=NN(C(N2N=C(C)C=C2C)N2N=C(C)C=C2C)C(C)=C1

PubChem CID 4359225
CAS 28791-97-1
Molecular Weight (g/mol) 298.39
MDL Number MFCD00958749
SMILES CC1=NN(C(N2N=C(C)C=C2C)N2N=C(C)C=C2C)C(C)=C1
IUPAC Name 1-[bis(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-3,5-dimethyl-1H-pyrazole
InChI Key COKUMKYWINNWLV-UHFFFAOYSA-N
Molecular Formula C16H22N6