Vitas-M small molecule compound
(3Z)-5-bromo-3-(3-octyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)-1-propyl-1,3-dihydro-2H-indol-2-one
Catalog ID
STK813564
SMILES CCCCCCCCN1C(=S)S/C(=C\2/c3cc(Br)ccc3N(C2=O)CCC)/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 C22H27BrN2O2S2 MW 495.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27BrN2O2S2/c1-3-5-6-7-8-9-13-25-21(27)19(29-22(25)28)18-16-14-15(23)10-11-17(16)24(12-4-2)20(18)26/h10-11,14H,3-9,12-13H2,1-2H3/b19-18-InChIKey
VVSKAMYVFCSUBS-HNENSFHCSA-NSynonyms
617698-13-2(3Z)5bromo3(3octyl4oxo2thioxo13thiazolidin5ylidene)1propyl13dihydro2Hindol2one
(5Z)5(5BROMO2OXO1PROPYLINDOL3YLIDENE)3OCTYL2SULFANYLIDENE13THIAZOLIDIN4ONE
5(5BROMO2OXO1PROPYLINDOLIN3YLIDENE)3OCTYL2THIOXOTHIAZOLIDIN4ONE
617698132
CCCCCCCCN1C(=O)C(=C2C3=C(C=CC(=C3)Br)N(C2=O)CCC)SC1=S
CCCCCCCCN1C(=S)SC(=C2c3cc(Br)ccc3N(C2=O)CCC)C1=O
InChI=1SC22H27BrN2O2S2c1356789132521(27)19(2922(25)28)18161415(23)101117(16)24(1242)20(18)26h101114H391213H212H3b1918
MFCD03534959
ZINC000100871559
ZINC100871559
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