Vitas-M small molecule compound
(5E)-3-(3-chlorophenyl)-5-{[5-(3-methyl-4-nitrophenyl)furan-2-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STL428278
SMILES Clc1cccc(c1)N1C(=S)S/C(=C/c2ccc(o2)c2ccc(c(c2)C)[N+](=O)[O-])/C1=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 C21H13ClN2O4S2 MW 456.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13ClN2O4S2/c1-12-9-13(5-7-17(12)24(26)27)18-8-6-16(28-18)11-19-20(25)23(21(29)30-19)15-4-2-3-14(22)10-15/h2-11H,1H3/b19-11+InChIKey
KFNXIWBZHQDOLT-YBFXNURJSA-NSynonyms
(5E)3(3chlorophenyl)5((5(3methyl4nitrophenyl)furan2yl)methylidene)2sulfanylidene13thiazolidin4one
(5E)3(3chlorophenyl)5((5(3methyl4nitrophenyl)furan2yl)methylidene)2thioxo13thiazolidin4one
CC1=C(C=CC(=C1)C2=CC=C(O2)C=C3C(=O)N(C(=S)S3)C4=CC(=CC=C4)Cl)(N+)(=O)(O)
Clc1cccc(c1)N1C(=S)SC(=Cc2ccc(o2)c2ccc(c(c2)C)(N+)(=O)(O))C1=O
InChI=1SC21H13ClN2O4S2c112913(5717(12)24(26)27)188616(2818)111920(25)23(21(29)3019)1542314(22)1015h211H1H3b1911+
MFCD02614999
ZINC000009310254
ZINC09310254
ZINC9310254
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