Vitas-M small molecule compound

ethyl (5Z)-4-oxo-2-(phenylamino)-5-(2,3,4-trimethoxybenzylidene)-4,5-dihydrothiophene-3-carboxylate

Catalog ID
STK158457
SMILES CCOC(=O)C1=C(Nc2ccccc2)S/C(=C\c2ccc(c(c2OC)OC)OC)/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/c1-5-30-23(26)18-19(25)17(31-22(18)24-15-9-7-6-8-10-15)13-14-11-12-16(27-2)21(29-4)20(14)28-3/h6-13,24H,5H2,1-4H3/b17-13-
InChIKey
FUDSPMHSKJGUOS-LGMDPLHJSA-N
Synonyms

CCOC(=O)C1=C(Nc2ccccc2)SC(=Cc2ccc(c(c2OC)OC)OC)C1=O
CCOC(=O)C1=C(SC(=CC2=C(C(=C(C=C2)OC)OC)OC)C1=O)NC3=CC=CC=C3
ETHYL(5Z)2ANILINO4OXO5((234TRIMETHOXYPHENYL)METHYLIDENE)THIOPHENE3CARBOXYLATE
ETHYL(5Z)4OXO2(PHENYLAMINO)5(234TRIMETHOXYBENZYLIDENE)45DIHYDROTHIOPHENE3CARBOXYLATE
InChI=1SC23H23NO6Sc153023(26)1819(25)17(3122(18)241597681015)1314111216(272)21(294)20(14)283h61324H5H214H3b1713
MFCD08679704
ZINC000009721124
ZINC09721124
ZINC9721124

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Available files

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