Vitas-M small molecule compound
(3Z)-1-(4-methylbenzyl)-3-(3-octyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)-1,3-dihydro-2H-indol-2-one
Catalog ID
STK813279
SMILES CCCCCCCCN1C(=S)S/C(=C\2/c3ccccc3N(C2=O)Cc2ccc(cc2)C)/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 C27H30N2O2S2 MW 478.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N2O2S2/c1-3-4-5-6-7-10-17-28-26(31)24(33-27(28)32)23-21-11-8-9-12-22(21)29(25(23)30)18-20-15-13-19(2)14-16-20/h8-9,11-16H,3-7,10,17-18H2,1-2H3/b24-23-InChIKey
YSPPJCMZZZCUCE-VHXPQNKSSA-NSynonyms
617696-17-0(3Z)1(4methylbenzyl)3(3octyl4oxo2thioxo13thiazolidin5ylidene)13dihydro2Hindol2one
(5Z)5(1((4METHYLPHENYL)METHYL)2OXOINDOL3YLIDENE)3OCTYL2SULFANYLIDENE13THIAZOLIDIN4ONE
5(1(4METHYLBENZYL)2OXOINDOLIN3YLIDENE)3OCTYL2THIOXOTHIAZOLIDIN4ONE
617696170
CCCCCCCCN1C(=O)C(=C2C3=CC=CC=C3N(C2=O)CC4=CC=C(C=C4)C)SC1=S
CCCCCCCCN1C(=S)SC(=C2c3ccccc3N(C2=O)Cc2ccc(cc2)C)C1=O
InChI=1SC27H30N2O2S2c13456710172826(31)24(3327(28)32)232111891222(21)29(25(23)30)1820151319(2)141620h891116H37101718H212H3b2423
MFCD03534952
ZINC000100871272
ZINC100871272
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