Vitas-M small molecule compound
(5E)-3-benzyl-5-{4-[3-(3,4-dimethylphenoxy)propoxy]benzylidene}-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK032958
SMILES S=C1S/C(=C/c2ccc(cc2)OCCCOc2ccc(c(c2)C)C)/C(=O)N1Cc1ccccc1
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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 C28H27NO3S2 MW 489.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27NO3S2/c1-20-9-12-25(17-21(20)2)32-16-6-15-31-24-13-10-22(11-14-24)18-26-27(30)29(28(33)34-26)19-23-7-4-3-5-8-23/h3-5,7-14,17-18H,6,15-16,19H2,1-2H3/b26-18+InChIKey
TWQCEZUMLNGYKT-NLRVBDNBSA-NSynonyms
(5E)3benzyl5((4(3(34dimethylphenoxy)propoxy)phenyl)methylidene)2sulfanylidene13thiazolidin4one
(5E)3BENZYL5(4(3(34DIMETHYLPHENOXY)PROPOXY)BENZYLIDENE)2THIOXO13THIAZOLIDIN4ONE
CC1=C(C=C(C=C1)OCCCOC2=CC=C(C=C2)C=C3C(=O)N(C(=S)S3)CC4=CC=CC=C4)C
InChI=1SC28H27NO3S2c12091225(1721(20)2)32166153124131022(111424)182627(30)29(28(33)3426)19237435823h357141718H6151619H212H3b2618+
MFCD08050367
S=C1SC(=Cc2ccc(cc2)OCCCOc2ccc(c(c2)C)C)C(=O)N1Cc1ccccc1
STK032958
ZINC000009144642
ZINC09144642
ZINC9144642
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