Vitas-M small molecule compound
(3Z)-1-benzyl-5-bromo-3-(3-octyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)-1,3-dihydro-2H-indol-2-one
Catalog ID
STK815207
SMILES CCCCCCCCN1C(=S)S/C(=C\2/c3cc(Br)ccc3N(C2=O)Cc2ccccc2)/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 C26H27BrN2O2S2 MW 543.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27BrN2O2S2/c1-2-3-4-5-6-10-15-28-25(31)23(33-26(28)32)22-20-16-19(27)13-14-21(20)29(24(22)30)17-18-11-8-7-9-12-18/h7-9,11-14,16H,2-6,10,15,17H2,1H3/b23-22-InChIKey
FEEIQWPSSDAYFN-FCQUAONHSA-NSynonyms
(3Z)1benzyl5bromo3(3octyl4oxo2thioxo13thiazolidin5ylidene)13dihydro2Hindol2one
(5Z)5(1BENZYL5BROMO2OXOINDOL3YLIDENE)3OCTYL2SULFANYLIDENE13THIAZOLIDIN4ONE
CCCCCCCCN1C(=O)C(=C2C3=C(C=CC(=C3)Br)N(C2=O)CC4=CC=CC=C4)SC1=S
CCCCCCCCN1C(=S)SC(=C2c3cc(Br)ccc3N(C2=O)Cc2ccccc2)C1=O
InChI=1SC26H27BrN2O2S2c12345610152825(31)23(3326(28)32)22201619(27)131421(20)29(24(22)30)1718118791218h79111416H26101517H21H3b2322
MFCD03534957
ZINC000100893593
ZINC100893593
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