Vitas-M small molecule compound
(5Z)-3-(2-chlorobenzyl)-5-{[1-(3-nitrophenyl)-1H-pyrrol-2-yl]methylidene}-1,3-thiazolidine-2,4-dione
Catalog ID
STK132275
SMILES O=C1S/C(=C\c2cccn2c2cccc(c2)[N+](=O)[O-])/C(=O)N1Cc1ccccc1Cl
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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 C21H14ClN3O4S MW 439.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14ClN3O4S/c22-18-9-2-1-5-14(18)13-24-20(26)19(30-21(24)27)12-16-8-4-10-23(16)15-6-3-7-17(11-15)25(28)29/h1-12H,13H2/b19-12-InChIKey
CVPKUGZDZICQRX-UNOMPAQXSA-NSynonyms
(5Z)3((2CHLOROPHENYL)METHYL)5((1(3NITROPHENYL)PYRROL2YL)METHYLIDENE)13THIAZOLIDINE24DIONE
(5Z)3(2CHLOROBENZYL)5((1(3NITROPHENYL)1HPYRROL2YL)METHYLIDENE)13THIAZOLIDINE24DIONE
C1=CC=C(C(=C1)CN2C(=O)C(=CC3=CC=CN3C4=CC(=CC=C4)(N+)(=O)(O))SC2=O)Cl
InChI=1SC21H14ClN3O4Sc2218921514(18)132420(26)19(3021(24)27)1216841023(16)1563717(1115)25(28)29h112H13H2b1912
MFCD04312345
O=C1SC(=Cc2cccn2c2cccc(c2)(N+)(=O)(O))C(=O)N1Cc1ccccc1Cl
ZINC000009234546
ZINC09234546
ZINC9234546
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