Vitas-M small molecule compound
ethyl 2-{[(2E)-2-cyano-3-(2-hydroxy-5-methoxyphenyl)prop-2-enoyl]amino}-4-(4-methylphenyl)thiophene-3-carboxylate
Catalog ID
STK952736
SMILES CCOC(=O)c1c(scc1c1ccc(cc1)C)NC(=O)/C(=C/c1cc(OC)ccc1O)/C#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 C25H22N2O5S MW 462.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N2O5S/c1-4-32-25(30)22-20(16-7-5-15(2)6-8-16)14-33-24(22)27-23(29)18(13-26)11-17-12-19(31-3)9-10-21(17)28/h5-12,14,28H,4H2,1-3H3,(H,27,29)/b18-11+InChIKey
XBKXXHMMKMIBFU-WOJGMQOQSA-NSynonyms
380455-53-8(E)ethyl2(2cyano3(2hydroxy5methoxyphenyl)acrylamido)4(ptolyl)thiophene3carboxylate
380455538
CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C)NC(=O)C(=CC3=C(C=CC(=C3)OC)O)C#N
CCOC(=O)c1c(scc1c1ccc(cc1)C)NC(=O)C(=Cc1cc(OC)ccc1O)C#N
ethyl2(((2E)2cyano3(2hydroxy5methoxyphenyl)prop2enoyl)amino)4(4methylphenyl)thiophene3carboxylate
ETHYL2(((E)2CYANO3(2HYDROXY5METHOXYPHENYL)PROP2ENOYL)AMINO)4(4METHYLPHENYL)THIOPHENE3CARBOXYLATE
ETHYL2((2E)2CYANO3(2HYDROXY5METHOXYPHENYL)PROP2ENOYLAMINO)4(4METHYLPHENYL)THIOPHENE3CARBOXYLATE
InChI=1SC25H22N2O5Sc143225(30)2220(167515(2)6816)143324(22)2723(29)18(1326)11171219(313)91021(17)28h5121428H4H213H3(H2729)b1811+
MFCD02957202
ZINC000002336815
ZINC02336815
ZINC2336815
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