Vitas-M small molecule compound

2-[(2-chloro-4-{(Z)-[3-(4-chlorobenzyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}-6-ethoxyphenoxy)methyl]benzonitrile

Catalog ID
STL353711
SMILES CCOc1cc(/C=C/2\SC(=O)N(C2=O)Cc2ccc(cc2)Cl)cc(c1OCc1ccccc1C#N)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 C27H20Cl2N2O4S MW 539.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20Cl2N2O4S/c1-2-34-23-12-18(11-22(29)25(23)35-16-20-6-4-3-5-19(20)14-30)13-24-26(32)31(27(33)36-24)15-17-7-9-21(28)10-8-17/h3-13H,2,15-16H2,1H3/b24-13-
InChIKey
GWIASPLCCZJSRZ-CFRMEGHHSA-N
Synonyms

2((2CHLORO4((Z)(3((4CHLOROPHENYL)METHYL)24DIOXO13THIAZOLIDIN5YLIDENE)METHYL)6ETHOXYPHENOXY)METHYL)BENZONITRILE
2((2chloro4((Z)(3(4chlorobenzyl)24dioxo13thiazolidin5ylidene)methyl)6ethoxyphenoxy)methyl)benzonitrile
CCOC1=C(C(=CC(=C1)C=C2C(=O)N(C(=O)S2)CC3=CC=C(C=C3)Cl)Cl)OCC4=CC=CC=C4C#N
CCOc1cc(C=C2SC(=O)N(C2=O)Cc2ccc(cc2)Cl)cc(c1OCc1ccccc1C#N)Cl
InChI=1SC27H20Cl2N2O4Sc1234231218(1122(29)25(23)351620643519(20)1430)132426(32)31(27(33)3624)15177921(28)10817h313H21516H21H3b2413
MFCD03032007
ZINC000033355171
ZINC33355171

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Available files

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