Vitas-M small molecule compound

(2Z,5E)-5-(1-ethylquinolin-2(1H)-ylidene)-3-(4-methylphenyl)-2-[3-(4-methylphenyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]-1,3-thiazolidin-4-one

Catalog ID
STK379911
SMILES CCn1/c(=c\2/s/c(=C/3\SC(=S)N(C3=O)c3ccc(cc3)C)/n(c2=O)c2ccc(cc2)C)/ccc2c1cccc2

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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 C31H25N3O2S3 MW 567.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H25N3O2S3/c1-4-32-24-8-6-5-7-21(24)13-18-25(32)26-28(35)33(22-14-9-19(2)10-15-22)30(38-26)27-29(36)34(31(37)39-27)23-16-11-20(3)12-17-23/h5-18H,4H2,1-3H3/b26-25+,30-27-
InChIKey
DXYPMIWMHZDPSH-PBEWFDSHSA-N
Synonyms

(2Z5E)5(1ethylquinolin2(1H)ylidene)3(4methylphenyl)2(3(4methylphenyl)4oxo2thioxo13thiazolidin5ylidene)13thiazolidin4one
(2Z5E)5(1ETHYLQUINOLIN2YLIDENE)3(4METHYLPHENYL)2(3(4METHYLPHENYL)4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)13THIAZOLIDIN4ONE
CCN1C(=C2C(=O)N(C(=C3C(=O)N(C(=S)S3)C4=CC=C(C=C4)C)S2)C5=CC=C(C=C5)C)C=CC6=CC=CC=C61
CCn1c(=c2sc(=C3SC(=S)N(C3=O)c3ccc(cc3)C)n(c2=O)c2ccc(cc2)C)ccc2c1cccc2
InChI=1SC31H25N3O2S3c143224865721(24)131825(32)2628(35)33(2214919(2)101522)30(3826)2729(36)34(31(37)3927)23161120(3)121723h518H4H213H3b2625+3027
MFCD02067736
ZINC000100199535
ZINC100199535

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Available files

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