Vitas-M small molecule compound

ethyl 2-[(5Z)-5-({2-[(2-cyanobenzyl)oxy]naphthalen-1-yl}methylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]propanoate

Catalog ID
STK178159
SMILES CCOC(=O)C(N1C(=O)S/C(=C\c2c(OCc3ccccc3C#N)ccc3c2cccc3)/C1=O)C

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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 C27H22N2O5S MW 486.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N2O5S/c1-3-33-26(31)17(2)29-25(30)24(35-27(29)32)14-22-21-11-7-6-8-18(21)12-13-23(22)34-16-20-10-5-4-9-19(20)15-28/h4-14,17H,3,16H2,1-2H3/b24-14-
InChIKey
ZVDYCBBFROOIMI-OYKKKHCWSA-N
Synonyms

CCOC(=O)C(C)N1C(=O)C(=CC2=C(C=CC3=CC=CC=C32)OCC4=CC=CC=C4C#N)SC1=O
CCOC(=O)C(N1C(=O)SC(=Cc2c(OCc3ccccc3C#N)ccc3c2cccc3)C1=O)C
ETHYL2((5Z)5((2((2CYANOBENZYL)OXY)NAPHTHALEN1YL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)PROPANOATE
ETHYL2((5Z)5((2((2CYANOPHENYL)METHOXY)NAPHTHALEN1YL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)PROPANOATE
InChI=1SC27H22N2O5Sc133326(31)17(2)2925(30)24(3527(29)32)1422211176818(21)121323(22)3416201054919(20)1528h41417H316H212H3b2414
MFCD04518290
ZINC000001008370
ZINC000001008372

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Available files

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