Vitas-M small molecule compound
methyl 5-carbamoyl-2-{[(2E)-2-cyano-3-(furan-2-yl)prop-2-enoyl]amino}-4-methylthiophene-3-carboxylate
Catalog ID
STK434258
SMILES N#C/C(=C\c1ccco1)/C(=O)Nc1sc(c(c1C(=O)OC)C)C(=O)N
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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 C16H13N3O5S MW 359.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13N3O5S/c1-8-11(16(22)23-2)15(25-12(8)13(18)20)19-14(21)9(7-17)6-10-4-3-5-24-10/h3-6H,1-2H3,(H2,18,20)(H,19,21)/b9-6+InChIKey
VBIFQKKSIJECMQ-RMKNXTFCSA-NSynonyms
CC1=C(SC(=C1C(=O)OC)NC(=O)C(=CC2=CC=CO2)C#N)C(=O)N
InChI=1SC16H13N3O5Sc1811(16(22)232)15(2512(8)13(18)20)1914(21)9(717)6104352410h36H12H3(H21820)(H1921)b96+
METHYL2((2E)2CYANO3(2FURYL)PROP2ENOYLAMINO)5CARBAMOYL4METHYLTHIOPHENE3CARBOXYLATE
methyl5carbamoyl2(((2E)2cyano3(furan2yl)prop2enoyl)amino)4methylthiophene3carboxylate
METHYL5CARBAMOYL2(((E)2CYANO3(FURAN2YL)PROP2ENOYL)AMINO)4METHYLTHIOPHENE3CARBOXYLATE
MFCD03942860
N#CC(=Cc1ccco1)C(=O)Nc1sc(c(c1C(=O)OC)C)C(=O)N
ZINC000006825036
ZINC06825036
ZINC6825036
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