Vitas-M small molecule compound
ethyl (5Z)-5-(4-ethoxybenzylidene)-4-oxo-2-(phenylamino)-4,5-dihydrothiophene-3-carboxylate
Catalog ID
STK006623
SMILES CCOC(=O)C1=C(Nc2ccccc2)S/C(=C\c2ccc(cc2)OCC)/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 C22H21NO4S MW 395.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO4S/c1-3-26-17-12-10-15(11-13-17)14-18-20(24)19(22(25)27-4-2)21(28-18)23-16-8-6-5-7-9-16/h5-14,23H,3-4H2,1-2H3/b18-14-InChIKey
RGIUIYSKEKOGEY-JXAWBTAJSA-NSynonyms
CCOC(=O)C1=C(Nc2ccccc2)SC(=Cc2ccc(cc2)OCC)C1=O
CCOC1=CC=C(C=C1)C=C2C(=O)C(=C(S2)NC3=CC=CC=C3)C(=O)OCC
ETHYL(5Z)2ANILINO5((4ETHOXYPHENYL)METHYLIDENE)4OXOTHIOPHENE3CARBOXYLATE
ETHYL(5Z)5((4ETHOXYPHENYL)METHYLIDENE)4OXO2(PHENYLAMINO)45DIHYDROTHIOPHENE3CARBOXYLATE
ETHYL(5Z)5(4ETHOXYBENZYLIDENE)4OXO2(PHENYLAMINO)45DIHYDROTHIOPHENE3CARBOXYLATE
InChI=1SC22H21NO4Sc132617121015(111317)141820(24)19(22(25)2742)21(2818)23168657916h51423H34H212H3b1814
MFCD02109776
STK006623
ZINC000002909352
ZINC02909352
ZINC2909352
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