Vitas-M small molecule compound

(5E)-3-(3-nitrobenzyl)-5-{2-[(3-nitrobenzyl)oxy]benzylidene}-1,3-thiazolidine-2,4-dione

Catalog ID
STK152693
SMILES O=C1S/C(=C/c2ccccc2OCc2cccc(c2)[N+](=O)[O-])/C(=O)N1Cc1cccc(c1)[N+](=O)[O-]

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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 C24H17N3O7S MW 491.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H17N3O7S/c28-23-22(35-24(29)25(23)14-16-5-3-8-19(11-16)26(30)31)13-18-7-1-2-10-21(18)34-15-17-6-4-9-20(12-17)27(32)33/h1-13H,14-15H2/b22-13+
InChIKey
GPHPDBFGMDZIAM-LPYMAVHISA-N
Synonyms

(5E)3(3NITROBENZYL)5(2((3NITROBENZYL)OXY)BENZYLIDENE)13THIAZOLIDINE24DIONE
(5E)5((2((3nitrophenyl)methoxy)phenyl)methylidene)3((3nitrophenyl)methyl)13thiazolidine24dione
5((2((3NITROPHENYL)METHOXY)PHENYL)METHYLENE)3((3NITROPHENYL)METHYL)13THIAZOLIDINE24DIONE
C1=CC=C(C(=C1)C=C2C(=O)N(C(=O)S2)CC3=CC(=CC=C3)(N+)(=O)(O))OCC4=CC(=CC=C4)(N+)(=O)(O)
InChI=1SC24H17N3O7Sc282322(3524(29)25(23)141653819(1116)26(30)31)13187121021(18)34151764920(1217)27(32)33h113H1415H2b2213+
MFCD03649529
O=C1SC(=Cc2ccccc2OCc2cccc(c2)(N+)(=O)(O))C(=O)N1Cc1cccc(c1)(N+)(=O)(O)
ZINC000008722241
ZINC08722241
ZINC8722241

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Available files

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