Vitas-M small molecule compound
(3Z)-5-bromo-3-(3-octyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)-1-pentyl-1,3-dihydro-2H-indol-2-one
Catalog ID
STK814953
SMILES CCCCCCCCN1C(=S)S/C(=C\2/c3cc(Br)ccc3N(C2=O)CCCCC)/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 C24H31BrN2O2S2 MW 523.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H31BrN2O2S2/c1-3-5-7-8-9-11-15-27-23(29)21(31-24(27)30)20-18-16-17(25)12-13-19(18)26(22(20)28)14-10-6-4-2/h12-13,16H,3-11,14-15H2,1-2H3/b21-20-InChIKey
GXAQIPSCCDNUPW-MRCUWXFGSA-NSynonyms
(3Z)5bromo3(3octyl4oxo2thioxo13thiazolidin5ylidene)1pentyl13dihydro2Hindol2one
(5Z)5(5BROMO2OXO1PENTYLINDOL3YLIDENE)3OCTYL2SULFANYLIDENE13THIAZOLIDIN4ONE
CCCCCCCCN1C(=O)C(=C2C3=C(C=CC(=C3)Br)N(C2=O)CCCCC)SC1=S
CCCCCCCCN1C(=S)SC(=C2c3cc(Br)ccc3N(C2=O)CCCCC)C1=O
InChI=1SC24H31BrN2O2S2c13578911152723(29)21(3124(27)30)20181617(25)121319(18)26(22(20)28)1410642h121316H3111415H212H3b2120
MFCD04442417
ZINC000100893095
ZINC100893095
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