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Pyrazoles
Description:
Compounds containing a pyrazole ring, which is a five-member aromatic ring with two nitrogen atoms (at positions 1 and 2) and three carbon atoms.
Ancestors:
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3-(1-Pyrazolyl)-1-propanolCas Number: 180741-37-1 Compound CID: 17608730Formula: C6H10N2O Molecular Weight: 126.16IUPAC Name: 3-pyrazol-1-ylpropan-1-olSMILES: C1=CN(N=C1)CCCOInChIKey: PMKIEDXXIYUBKC-UHFFFAOYSA-NInChI: InChI=1S/C6H10N2O/c9-6-2-5-8-4-1-3-7-8/h1,3-4,9H,2,5-6H2 -
3-(1-Methyl-1H-pyrazol-5-yl)anilineCas Number: 910037-08-0 Compound CID: 24229626Formula: C10H11N3 Molecular Weight: 173.22IUPAC Name: 3-(2-methylpyrazol-3-yl)anilineSMILES: CN1C(=CC=N1)C2=CC(=CC=C2)NInChIKey: KEYWGUASUNFUCS-UHFFFAOYSA-NInChI: InChI=1S/C10H11N3/c1-13-10(5-6-12-13)8-3-2-4-9(11)7-8/h2-7H,11H2,1H3
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3-(1-Methyl-1H-pyrazol-5-yl)benzene-1-sulfonyl chlorideCas Number: 941716-85-4 Compound CID: 24229623Formula: C10H9ClN2O2S Molecular Weight: 256.709IUPAC Name: 3-(2-methylpyrazol-3-yl)benzenesulfonyl chlorideSMILES: CN1C(=CC=N1)C2=CC(=CC=C2)S(=O)(=O)ClInChIKey: XVYMMAKBNVXHKR-UHFFFAOYSA-NInChI: InChI=1S/C10H9ClN2O2S/c1-13-10(5-6-12-13)8-3-2-4-9(7-8)16(11,14)15/h2-7H,1H3
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3-(1-Methyl-1H-pyrazol-4-yl)propanoic acidCas Number: 796845-56-2 Compound CID: 7017681Formula: C7H10N2O2 Molecular Weight: 154.17IUPAC Name: 3-(1-methylpyrazol-4-yl)propanoic acidSMILES: CN1C=C(C=N1)CCC(=O)OInChIKey: ZTSFRVGFCBTSDZ-UHFFFAOYSA-NInChI: InChI=1S/C7H10N2O2/c1-9-5-6(4-8-9)2-3-7(10)11/h4-5H,2-3H2,1H3,(H,10,11)
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3-(1H-Pyrazol-4-yl)benzoic acidCas Number: 1002535-21-8 Compound CID: 7174253Formula: C10H8N2O2 Molecular Weight: 188.18IUPAC Name: 3-(1H-pyrazol-4-yl)benzoic acidSMILES: C1=CC(=CC(=C1)C(=O)O)C2=CNN=C2InChIKey: BXSUQWZHUHROLP-UHFFFAOYSA-NInChI: InChI=1S/C10H8N2O2/c13-10(14)8-3-1-2-7(4-8)9-5-11-12-6-9/h1-6H,(H,11,12)(H,13,14)
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3-(1-Methyl-1H-pyrazol-4-yl)anilineCas Number: 1089278-81-8 Compound CID: 28875330Formula: C10H11N3 Molecular Weight: 173.22IUPAC Name: 3-(1-methylpyrazol-4-yl)anilineSMILES: CN1C=C(C=N1)C2=CC(=CC=C2)NInChIKey: HFXYSXJBVBJYMT-UHFFFAOYSA-NInChI: InChI=1S/C10H11N3/c1-13-7-9(6-12-13)8-3-2-4-10(11)5-8/h2-7H,11H2,1H3
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3-(1H-Pyrazol-1-yl)propanenitrileCas Number: 88393-88-8 Compound CID: 7023134Formula: C6H7N3 Molecular Weight: 121.14IUPAC Name: 3-pyrazol-1-ylpropanenitrileSMILES: C1=CN(N=C1)CCC#NInChIKey: SJXLTSDYZRWRQH-UHFFFAOYSA-NInChI: InChI=1S/C6H7N3/c7-3-1-5-9-6-2-4-8-9/h2,4,6H,1,5H2
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3-(1H-Pyrazol-1-yl)benzonitrileCas Number: 25699-82-5 Compound CID: 7164581Formula: C10H7N3 Molecular Weight: 169.18IUPAC Name: 3-pyrazol-1-ylbenzonitrileSMILES: C1=CC(=CC(=C1)N2C=CC=N2)C#NInChIKey: KLZKYUMVLIQOFX-UHFFFAOYSA-NInChI: InChI=1S/C10H7N3/c11-8-9-3-1-4-10(7-9)13-6-2-5-12-13/h1-7H
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3-(1H-Pyrazol-1-yl)benzaldehydeCas Number: 852227-92-0 Compound CID: 7172309Formula: C10H8N2O Molecular Weight: 172.18IUPAC Name: 3-pyrazol-1-ylbenzaldehydeSMILES: C1=CC(=CC(=C1)N2C=CC=N2)C=OInChIKey: NKFXXJOWQSOGOF-UHFFFAOYSA-NInChI: InChI=1S/C10H8N2O/c13-8-9-3-1-4-10(7-9)12-6-2-5-11-12/h1-8H
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2-Ethyl-4，5，6，7-tetrahydro-2H-indazole-3-carboxylic acidCas Number: 32275-62-0 Compound CID: 6498680Formula: C10H14N2O2 Molecular Weight: 194.23IUPAC Name: 2-ethyl-4,5,6,7-tetrahydroindazole-3-carboxylic acidSMILES: CCN1C(=C2CCCCC2=N1)C(=O)OInChIKey: SKWGJKUOJHNXHI-UHFFFAOYSA-NInChI: InChI=1S/C10H14N2O2/c1-2-12-9(10(13)14)7-5-3-4-6-8(7)11-12/h2-6H2,1H3,(H,13,14)
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2-Amino-4-(1-pyrazolyl)benzoic AcidCas Number: 1186663-55-7 Compound CID: 53406505Formula: C10H9N3O2 Molecular Weight: 203.19IUPAC Name: 2-amino-4-pyrazol-1-ylbenzoic acidSMILES: C1=CN(N=C1)C2=CC(=C(C=C2)C(=O)O)NInChIKey: MCADMJGMKMNLIE-UHFFFAOYSA-NInChI: InChI=1S/C10H9N3O2/c11-9-6-7(13-5-1-4-12-13)2-3-8(9)10(14)15/h1-6H,11H2,(H,14,15)
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2-(5-AMINO-3-METHYL-PYRAZOL-1-YL)-ETHANOLCas Number: 51546-08-8 Compound CID: 5018373Formula: C6H11N3O Molecular Weight: 141.17IUPAC Name: 2-(5-amino-3-methylpyrazol-1-yl)ethanolSMILES: CC1=NN(C(=C1)N)CCOInChIKey: ANQYOZSPKNDFPD-UHFFFAOYSA-NInChI: InChI=1S/C6H11N3O/c1-5-4-6(7)9(8-5)2-3-10/h4,10H,2-3,7H2,1H3
