Vitas-M small molecule compound
(3Z)-5-bromo-3-{3-[2-(4-methoxyphenyl)ethyl]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene}-1-pentyl-1,3-dihydro-2H-indol-2-one
Catalog ID
STK814952
SMILES CCCCCN1c2ccc(cc2/C(=C\2/SC(=S)N(C2=O)CCc2ccc(cc2)OC)/C1=O)Br
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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 C25H25BrN2O3S2 MW 545.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25BrN2O3S2/c1-3-4-5-13-27-20-11-8-17(26)15-19(20)21(23(27)29)22-24(30)28(25(32)33-22)14-12-16-6-9-18(31-2)10-7-16/h6-11,15H,3-5,12-14H2,1-2H3/b22-21-InChIKey
CFNODXALUOGPAS-DQRAZIAOSA-NSynonyms
(3Z)5bromo3(3(2(4methoxyphenyl)ethyl)4oxo2thioxo13thiazolidin5ylidene)1pentyl13dihydro2Hindol2one
(5Z)5(5BROMO2OXO1PENTYLINDOL3YLIDENE)3(2(4METHOXYPHENYL)ETHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
CCCCCN1C2=C(C=C(C=C2)Br)C(=C3C(=O)N(C(=S)S3)CCC4=CC=C(C=C4)OC)C1=O
CCCCCN1c2ccc(cc2C(=C2SC(=S)N(C2=O)CCc2ccc(cc2)OC)C1=O)Br
InChI=1SC25H25BrN2O3S2c134513272011817(26)1519(20)21(23(27)29)2224(30)28(25(32)3322)1412166918(312)10716h61115H351214H212H3b2221
MFCD04442416
ZINC000100893092
ZINC100893092
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