Vitas-M small molecule compound
ethyl 5-[({4-[(4-chlorobenzyl)oxy]-3-methoxyphenyl}carbonyl)amino]-4-cyano-3-methylthiophene-2-carboxylate
Catalog ID
STK031291
SMILES CCOC(=O)c1sc(c(c1C)C#N)NC(=O)c1ccc(c(c1)OC)OCc1ccc(cc1)Cl
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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 C24H21ClN2O5S MW 484.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21ClN2O5S/c1-4-31-24(29)21-14(2)18(12-26)23(33-21)27-22(28)16-7-10-19(20(11-16)30-3)32-13-15-5-8-17(25)9-6-15/h5-11H,4,13H2,1-3H3,(H,27,28)InChIKey
QINAYDKEMAVTEB-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(C(=C(S1)NC(=O)C2=CC(=C(C=C2)OCC3=CC=C(C=C3)Cl)OC)C#N)C
CCOC(=O)c1sc(c(c1C)C#N)NC(=O)c1ccc(c(c1)OC)OCc1ccc(cc1)Cl
ETHYL5(((4((4CHLOROBENZYL)OXY)3METHOXYPHENYL)CARBONYL)AMINO)4CYANO3METHYLTHIOPHENE2CARBOXYLATE
ETHYL5((4((4CHLOROPHENYL)METHOXY)3METHOXYBENZOYL)AMINO)4CYANO3METHYLTHIOPHENE2CARBOXYLATE
InChI=1SC24H21ClN2O5Sc143124(29)2114(2)18(1226)23(3321)2722(28)1671019(20(1116)303)3213155817(25)9615h511H413H213H3(H2728)
MFCD03241744
STK031291
ZINC000013940875
ZINC13940875
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