Vitas-M small molecule compound
(5E)-5-{[5-(2-methyl-4-nitrophenyl)furan-2-yl]methylidene}-3-(4-nitrophenyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STL418686
SMILES S=C1S/C(=C/c2ccc(o2)c2ccc(cc2C)[N+](=O)[O-])/C(=O)N1c1ccc(cc1)[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 C21H13N3O6S2 MW 467.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13N3O6S2/c1-12-10-15(24(28)29)6-8-17(12)18-9-7-16(30-18)11-19-20(25)22(21(31)32-19)13-2-4-14(5-3-13)23(26)27/h2-11H,1H3/b19-11+InChIKey
VWNURFBNUYHNTD-YBFXNURJSA-NSynonyms
(5E)5((5(2methyl4nitrophenyl)furan2yl)methylidene)3(4nitrophenyl)2sulfanylidene13thiazolidin4one
(5E)5((5(2methyl4nitrophenyl)furan2yl)methylidene)3(4nitrophenyl)2thioxo13thiazolidin4one
CC1=C(C=CC(=C1)(N+)(=O)(O))C2=CC=C(O2)C=C3C(=O)N(C(=S)S3)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC21H13N3O6S2c1121015(24(28)29)6817(12)189716(3018)111920(25)22(21(31)3219)132414(5313)23(26)27h211H1H3b1911+
MFCD02627720
S=C1SC(=Cc2ccc(o2)c2ccc(cc2C)(N+)(=O)(O))C(=O)N1c1ccc(cc1)(N+)(=O)(O)
ZINC000015011875
ZINC15011875
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