Vitas-M small molecule compound
methyl 2-{[(2E)-2-cyano-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]amino}-4,5-dimethylthiophene-3-carboxylate
Catalog ID
STK952759
SMILES N#C/C(=C\c1ccc(c(c1)OC)O)/C(=O)Nc1sc(c(c1C(=O)OC)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 C19H18N2O5S MW 386.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N2O5S/c1-10-11(2)27-18(16(10)19(24)26-4)21-17(23)13(9-20)7-12-5-6-14(22)15(8-12)25-3/h5-8,22H,1-4H3,(H,21,23)/b13-7+InChIKey
YJLPHLJOZJNFMJ-NTUHNPAUSA-NSynonyms
379731-02-9379731029
CC1=C(SC(=C1C(=O)OC)NC(=O)C(=CC2=CC(=C(C=C2)O)OC)C#N)C
InChI=1SC19H18N2O5Sc11011(2)2718(16(10)19(24)264)2117(23)13(920)7125614(22)15(812)253h5822H14H3(H2123)b137+
methyl2(((2E)2cyano3(4hydroxy3methoxyphenyl)prop2enoyl)amino)45dimethylthiophene3carboxylate
METHYL2(((E)2CYANO3(4HYDROXY3METHOXYPHENYL)PROP2ENOYL)AMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
METHYL2((2E)2CYANO3(4HYDROXY3METHOXYPHENYL)PROP2ENOYLAMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
MFCD02957164
N#CC(=Cc1ccc(c(c1)OC)O)C(=O)Nc1sc(c(c1C(=O)OC)C)C
ZINC000001453544
ZINC01453544
ZINC1453544
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