Vitas-M small molecule compound
(5E)-5-{4-[(4-chlorophenyl)sulfanyl]-3-nitrobenzylidene}-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STL428654
SMILES C=CCN1C(=S)S/C(=C/c2ccc(c(c2)[N+](=O)[O-])Sc2ccc(cc2)Cl)/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 C19H13ClN2O3S3 MW 448.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13ClN2O3S3/c1-2-9-21-18(23)17(28-19(21)26)11-12-3-8-16(15(10-12)22(24)25)27-14-6-4-13(20)5-7-14/h2-8,10-11H,1,9H2/b17-11+InChIKey
OWOMSCIWILFZOC-GZTJUZNOSA-NSynonyms
(5E)5((4(4CHLOROPHENYL)SULFANYL3NITROPHENYL)METHYLIDENE)3PROP2ENYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(5E)5(4((4chlorophenyl)sulfanyl)3nitrobenzylidene)3(prop2en1yl)2thioxo13thiazolidin4one
C=CCN1C(=O)C(=CC2=CC(=C(C=C2)SC3=CC=C(C=C3)Cl)(N+)(=O)(O))SC1=S
C=CCN1C(=S)SC(=Cc2ccc(c(c2)(N+)(=O)(O))Sc2ccc(cc2)Cl)C1=O
InChI=1SC19H13ClN2O3S3c1292118(23)17(2819(21)26)11123816(15(1012)22(24)25)27146413(20)5714h281011H19H2b1711+
MFCD04084428
ZINC000013546296
ZINC13546296
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