Vitas-M small molecule compound
ethyl 4,5-dimethyl-2-{[4-(3-nitro-1H-1,2,4-triazol-1-yl)butanoyl]amino}thiophene-3-carboxylate
Catalog ID
STK342092
SMILES CCOC(=O)c1c(NC(=O)CCCn2cnc(n2)[N+](=O)[O-])sc(c1C)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 C15H19N5O5S MW 381.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H19N5O5S/c1-4-25-14(22)12-9(2)10(3)26-13(12)17-11(21)6-5-7-19-8-16-15(18-19)20(23)24/h8H,4-7H2,1-3H3,(H,17,21)InChIKey
WTOFPVMZTILUGG-UHFFFAOYSA-NSynonyms
687575-15-1687575151
CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CCCN2C=NC(=N2)(N+)(=O)(O)
CCOC(=O)c1c(NC(=O)CCCn2cnc(n2)(N+)(=O)(O))sc(c1C)C
ethyl45dimethyl2((4(3nitro1H124triazol1yl)butanoyl)amino)thiophene3carboxylate
ETHYL45DIMETHYL2(4(3NITRO(124TRIAZOLYL))BUTANOYLAMINO)THIOPHENE3CARBOXYLATE
ETHYL45DIMETHYL2(4(3NITRO124TRIAZOL1YL)BUTANOYLAMINO)THIOPHENE3CARBOXYLATE
InChI=1SC15H19N5O5Sc142514(22)129(2)10(3)2613(12)1711(21)6571981615(1819)20(23)24h8H47H213H3(H1721)
MFCD06164525
ZINC000002887812
ZINC02887812
ZINC2887812
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