Vitas-M small molecule compound
(5E)-5-{[5-(2-bromo-4-methylphenyl)furan-2-yl]methylidene}-3-(3-nitrophenyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK392796
SMILES Cc1ccc(c(c1)Br)c1ccc(o1)/C=C\1/SC(=S)N(C1=O)c1cccc(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 C21H13BrN2O4S2 MW 501.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13BrN2O4S2/c1-12-5-7-16(17(22)9-12)18-8-6-15(28-18)11-19-20(25)23(21(29)30-19)13-3-2-4-14(10-13)24(26)27/h2-11H,1H3/b19-11+InChIKey
QKWQFAWMPORFTE-YBFXNURJSA-NSynonyms
(5E)5((5(2bromo4methylphenyl)furan2yl)methylidene)3(3nitrophenyl)2sulfanylidene13thiazolidin4one
(5E)5((5(2bromo4methylphenyl)furan2yl)methylidene)3(3nitrophenyl)2thioxo13thiazolidin4one
5((5(2BROMO4METHYLPHENYL)(2FURYL))METHYLENE)3(3NITROPHENYL)2THIOXO13THIAZOLIDIN4ONE
CC1=CC(=C(C=C1)C2=CC=C(O2)C=C3C(=O)N(C(=S)S3)C4=CC(=CC=C4)(N+)(=O)(O))Br
Cc1ccc(c(c1)Br)c1ccc(o1)C=C1SC(=S)N(C1=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC21H13BrN2O4S2c1125716(17(22)912)188615(2818)111920(25)23(21(29)3019)1332414(1013)24(26)27h211H1H3b1911+
MFCD01590207
ZINC000008721782
ZINC08721782
ZINC8721782
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