Vitas-M small molecule compound
(3Z)-5-bromo-1-hexyl-3-{3-[2-(4-methoxyphenyl)ethyl]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene}-1,3-dihydro-2H-indol-2-one
Catalog ID
STK814910
SMILES CCCCCCN1C(=O)/C(=C/2\SC(=S)N(C2=O)CCc2ccc(cc2)OC)/c2c1ccc(c2)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 C26H27BrN2O3S2 MW 559.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27BrN2O3S2/c1-3-4-5-6-14-28-21-12-9-18(27)16-20(21)22(24(28)30)23-25(31)29(26(33)34-23)15-13-17-7-10-19(32-2)11-8-17/h7-12,16H,3-6,13-15H2,1-2H3/b23-22-InChIKey
HHASZAAKNPWSQC-FCQUAONHSA-NSynonyms
(3Z)5bromo1hexyl3(3(2(4methoxyphenyl)ethyl)4oxo2thioxo13thiazolidin5ylidene)13dihydro2Hindol2one
(5Z)5(5BROMO1HEXYL2OXOINDOL3YLIDENE)3(2(4METHOXYPHENYL)ETHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
CCCCCCN1C(=O)C(=C2SC(=S)N(C2=O)CCc2ccc(cc2)OC)c2c1ccc(c2)Br
CCCCCCN1C2=C(C=C(C=C2)Br)C(=C3C(=O)N(C(=S)S3)CCC4=CC=C(C=C4)OC)C1=O
InChI=1SC26H27BrN2O3S2c1345614282112918(27)1620(21)22(24(28)30)2325(31)29(26(33)3423)15131771019(322)11817h71216H361315H212H3b2322
MFCD04442396
ZINC000100893012
ZINC100893012
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