Vitas-M small molecule compound

ethyl 4-(5-{(E)-[(2Z)-2-{2-[(2-chlorophenyl)amino]-1-cyano-2-oxoethylidene}-4-oxo-3-phenyl-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoate

Catalog ID
STK553253
SMILES CCOC(=O)c1ccc(cc1)c1ccc(o1)/C=c\1/s/c(=C(\C(=O)Nc2ccccc2Cl)/C#N)/n(c1=O)c1ccccc1

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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 C32H22ClN3O5S MW 596.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H22ClN3O5S/c1-2-40-32(39)21-14-12-20(13-15-21)27-17-16-23(41-27)18-28-30(38)36(22-8-4-3-5-9-22)31(42-28)24(19-34)29(37)35-26-11-7-6-10-25(26)33/h3-18H,2H2,1H3,(H,35,37)/b28-18+,31-24-
InChIKey
CGXLMJKEKFWMJH-ZTDDORFBSA-N
Synonyms

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=C3C(=O)N(C(=C(C#N)C(=O)NC4=CC=CC=C4Cl)S3)C5=CC=CC=C5
CCOC(=O)c1ccc(cc1)c1ccc(o1)C=c1sc(=C(C(=O)Nc2ccccc2Cl)C#N)n(c1=O)c1ccccc1
ethyl4(5((E)((2Z)2(2((2chlorophenyl)amino)1cyano2oxoethylidene)4oxo3phenyl13thiazolidin5ylidene)methyl)furan2yl)benzoate
ETHYL4(5((E)((2Z)2(2(2CHLOROANILINO)1CYANO2OXOETHYLIDENE)4OXO3PHENYL13THIAZOLIDIN5YLIDENE)METHYL)FURAN2YL)BENZOATE
ethyl4(5((E)((Z)2(2((2chlorophenyl)amino)1cyano2oxoethylidene)4oxo3phenylthiazolidin5ylidene)methyl)furan2yl)benzoate
InChI=1SC32H22ClN3O5Sc124032(39)21141220(131521)27171623(4127)182830(38)36(228435922)31(4228)24(1934)29(37)352611761025(26)33h318H2H21H3(H3537)b2818+3124
MFCD03678883
ZINC000097966718
ZINC97966718

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Available files

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