Vitas-M small molecule compound
methyl 2-{[(2E)-2-cyano-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]amino}-5-methylthiophene-3-carboxylate
Catalog ID
STK434364
SMILES N#C/C(=C\c1ccc(c(c1)OC)O)/C(=O)Nc1sc(cc1C(=O)OC)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 C18H16N2O5S MW 372.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N2O5S/c1-10-6-13(18(23)25-3)17(26-10)20-16(22)12(9-19)7-11-4-5-14(21)15(8-11)24-2/h4-8,21H,1-3H3,(H,20,22)/b12-7+InChIKey
HMSLYHATGMGDGN-KPKJPENVSA-NSynonyms
CC1=CC(=C(S1)NC(=O)C(=CC2=CC(=C(C=C2)O)OC)C#N)C(=O)OC
InChI=1SC18H16N2O5Sc110613(18(23)253)17(2610)2016(22)12(919)7114514(21)15(811)242h4821H13H3(H2022)b127+
methyl2(((2E)2cyano3(4hydroxy3methoxyphenyl)prop2enoyl)amino)5methylthiophene3carboxylate
METHYL2(((E)2CYANO3(4HYDROXY3METHOXYPHENYL)PROP2ENOYL)AMINO)5METHYLTHIOPHENE3CARBOXYLATE
METHYL2((2E)2CYANO3(4HYDROXY3METHOXYPHENYL)PROP2ENOYLAMINO)5METHYLTHIOPHENE3CARBOXYLATE
MFCD03942755
N#CC(=Cc1ccc(c(c1)OC)O)C(=O)Nc1sc(cc1C(=O)OC)C
ZINC000006825564
ZINC06825564
ZINC6825564
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