Vitas-M small molecule compound
ethyl (5Z)-5-[4-(acetyloxy)-3-methoxybenzylidene]-2-[(4-chlorophenyl)amino]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Catalog ID
STK068303
SMILES CCOC(=O)C1=C(Nc2ccc(cc2)Cl)S/C(=C\c2ccc(c(c2)OC)OC(=O)C)/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 C23H20ClNO6S MW 473.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20ClNO6S/c1-4-30-23(28)20-21(27)19(32-22(20)25-16-8-6-15(24)7-9-16)12-14-5-10-17(31-13(2)26)18(11-14)29-3/h5-12,25H,4H2,1-3H3/b19-12-InChIKey
XCCDQWZRIWCOMD-UNOMPAQXSA-NSynonyms
CCOC(=O)C1=C(Nc2ccc(cc2)Cl)SC(=Cc2ccc(c(c2)OC)OC(=O)C)C1=O
CCOC(=O)C1=C(SC(=CC2=CC(=C(C=C2)OC(=O)C)OC)C1=O)NC3=CC=C(C=C3)Cl
ETHYL(5Z)5((4ACETYLOXY3METHOXYPHENYL)METHYLIDENE)2(4CHLOROANILINO)4OXOTHIOPHENE3CARBOXYLATE
ETHYL(5Z)5(4(ACETYLOXY)3METHOXYBENZYLIDENE)2((4CHLOROPHENYL)AMINO)4OXO45DIHYDROTHIOPHENE3CARBOXYLATE
InChI=1SC23H20ClNO6Sc143023(28)2021(27)19(3222(20)25168615(24)7916)121451017(3113(2)26)18(1114)293h51225H4H213H3b1912
MFCD03712291
STK068303
ZINC000006227906
ZINC06227906
ZINC6227906
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Check stock on Vitas-MAvailable files
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