Vitas-M small molecule compound
(5Z)-3-(3,4-dichlorobenzyl)-5-{[1-(3-nitrophenyl)-1H-pyrrol-2-yl]methylidene}-1,3-thiazolidine-2,4-dione
Catalog ID
STL375983
SMILES O=C1S/C(=C\c2cccn2c2cccc(c2)[N+](=O)[O-])/C(=O)N1Cc1ccc(c(c1)Cl)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 C21H13Cl2N3O4S MW 474.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13Cl2N3O4S/c22-17-7-6-13(9-18(17)23)12-25-20(27)19(31-21(25)28)11-15-5-2-8-24(15)14-3-1-4-16(10-14)26(29)30/h1-11H,12H2/b19-11-InChIKey
CNAQKBFKSXNGNB-ODLFYWEKSA-NSynonyms
(5Z)3((34DICHLOROPHENYL)METHYL)5((1(3NITROPHENYL)PYRROL2YL)METHYLIDENE)13THIAZOLIDINE24DIONE
(5Z)3(34dichlorobenzyl)5((1(3nitrophenyl)1Hpyrrol2yl)methylidene)13thiazolidine24dione
C1=CC(=CC(=C1)(N+)(=O)(O))N2C=CC=C2C=C3C(=O)N(C(=O)S3)CC4=CC(=C(C=C4)Cl)Cl
InChI=1SC21H13Cl2N3O4Sc22177613(918(17)23)122520(27)19(3121(25)28)111552824(15)1431416(1014)26(29)30h111H12H2b1911
MFCD04313119
O=C1SC(=Cc2cccn2c2cccc(c2)(N+)(=O)(O))C(=O)N1Cc1ccc(c(c1)Cl)Cl
ZINC000034931641
ZINC34931641
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