Vitas-M small molecule compound
ethyl (5Z)-5-(3-ethoxy-4-hydroxybenzylidene)-2-[(4-methoxyphenyl)amino]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Catalog ID
STK055509
SMILES CCOC(=O)C1=C(Nc2ccc(cc2)OC)S/C(=C\c2ccc(c(c2)OCC)O)/C1=O
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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 C23H23NO6S MW 441.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23NO6S/c1-4-29-18-12-14(6-11-17(18)25)13-19-21(26)20(23(27)30-5-2)22(31-19)24-15-7-9-16(28-3)10-8-15/h6-13,24-25H,4-5H2,1-3H3/b19-13-InChIKey
HOJMPBXDIRGQLV-UYRXBGFRSA-NSynonyms
CCOC(=O)C1=C(Nc2ccc(cc2)OC)SC(=Cc2ccc(c(c2)OCC)O)C1=O
CCOC1=C(C=CC(=C1)C=C2C(=O)C(=C(S2)NC3=CC=C(C=C3)OC)C(=O)OCC)O
ETHYL(5Z)5((3ETHOXY4HYDROXYPHENYL)METHYLIDENE)2(4METHOXYANILINO)4OXOTHIOPHENE3CARBOXYLATE
ETHYL(5Z)5(3ETHOXY4HYDROXYBENZYLIDENE)2((4METHOXYPHENYL)AMINO)4OXO45DIHYDROTHIOPHENE3CARBOXYLATE
ETHYL5((3ETHOXY4HYDROXYPHENYL)METHYLENE)2((4METHOXYPHENYL)AMINO)4OXOTHIOPHENE3CARBOXYLATE
InChI=1SC23H23NO6Sc1429181214(61117(18)25)131921(26)20(23(27)3052)22(3119)24157916(283)10815h6132425H45H213H3b1913
MFCD02109785
STK055509
ZINC000000872417
ZINC00872417
ZINC872417
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