Vitas-M small molecule compound

(5Z)-3-(1,1-dioxidotetrahydrothiophen-3-yl)-5-{[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one

Catalog ID
STK706370
SMILES S=C1S/C(=C\c2cn(nc2c2cccc(c2)[N+](=O)[O-])c2ccccc2)/C(=O)N1C1CCS(=O)(=O)C1

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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 C23H18N4O5S3 MW 526.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18N4O5S3/c28-22-20(34-23(33)26(22)19-9-10-35(31,32)14-19)12-16-13-25(17-6-2-1-3-7-17)24-21(16)15-5-4-8-18(11-15)27(29)30/h1-8,11-13,19H,9-10,14H2/b20-12-
InChIKey
RXQIUDLJDRSYBA-NDENLUEZSA-N
Synonyms
955863-98-6
(5Z)3(11dioxidotetrahydrothiophen3yl)5((3(3nitrophenyl)1phenyl1Hpyrazol4yl)methylidene)2thioxo13thiazolidin4one
(5Z)3(11DIOXOTHIOLAN3YL)5((3(3NITROPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3(11dioxidotetrahydrothiophen3yl)5((3(3nitrophenyl)1phenyl1Hpyrazol4yl)methylene)2thioxothiazolidin4one
3(5((3(3NITROPHENYL)1PHENYLPYRAZOL4YL)METHYLENE)4OXO2THIOXO13THIAZOLIDIN3YL)THIOLANE11DIONE
955863986
C1CS(=O)(=O)CC1N2C(=O)C(=CC3=CN(N=C3C4=CC(=CC=C4)(N+)(=O)(O))C5=CC=CC=C5)SC2=S
InChI=1SC23H18N4O5S3c282220(3423(33)26(22)1991035(3132)1419)12161325(176213717)2421(16)1554818(1115)27(29)30h18111319H91014H2b2012
MFCD03463082
S=C1SC(=Cc2cn(nc2c2cccc(c2)(N+)(=O)(O))c2ccccc2)C(=O)N1C1CCS(=O)(=O)C1
ZINC000100915236
ZINC000100915238

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Available files

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