Vitas-M small molecule compound
methyl 5-methyl-2-({[1-(3-methylbenzyl)-1H-1,2,4-triazol-3-yl]carbamothioyl}amino)thiophene-3-carboxylate
Catalog ID
STK467457
SMILES COC(=O)c1cc(sc1NC(=S)Nc1ncn(n1)Cc1cccc(c1)C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C18H19N5O2S2 MW 401.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N5O2S2/c1-11-5-4-6-13(7-11)9-23-10-19-17(22-23)21-18(26)20-15-14(16(24)25-3)8-12(2)27-15/h4-8,10H,9H2,1-3H3,(H2,20,21,22,26)InChIKey
BIWLJFBJBXPXIL-UHFFFAOYSA-NSynonyms
CC1=CC(=CC=C1)CN2C=NC(=N2)NC(=S)NC3=C(C=C(S3)C)C(=O)OC
InChI=1SC18H19N5O2S2c11154613(711)923101917(2223)2118(26)201514(16(24)253)812(2)2715h4810H9H213H3(H220212226)
METHYL5METHYL2((((1((3METHYLPHENYL)METHYL)(124TRIAZOL3YL))AMINO)THIOXOMETHYL)AMINO)THIOPHENE3CARBOXYLATE
methyl5methyl2(((1(3methylbenzyl)1H124triazol3yl)carbamothioyl)amino)thiophene3carboxylate
methyl5methyl2((1((3methylphenyl)methyl)124triazol3yl)carbamothioylamino)thiophene3carboxylate
MFCD06757754
ZINC000017082256
ZINC17082256
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