Vitas-M small molecule compound
(3E)-5-bromo-3-{3-[2-(4-methoxyphenyl)ethyl]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene}-1,3-dihydro-2H-indol-2-one
Catalog ID
STL005693
SMILES COc1ccc(cc1)CCN1C(=S)S/C(=C\2/C(=O)Nc3c2cc(Br)cc3)/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 C20H15BrN2O3S2 MW 475.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15BrN2O3S2/c1-26-13-5-2-11(3-6-13)8-9-23-19(25)17(28-20(23)27)16-14-10-12(21)4-7-15(14)22-18(16)24/h2-7,10H,8-9H2,1H3,(H,22,24)/b17-16+InChIKey
FFIVWVUTDKFJIU-WUKNDPDISA-NSynonyms
(3E)5bromo3(3(2(4methoxyphenyl)ethyl)4oxo2thioxo13thiazolidin5ylidene)13dihydro2Hindol2one
(5E)5(5BROMO2OXO1HINDOL3YLIDENE)3(2(4METHOXYPHENYL)ETHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(E)5(5bromo2oxoindolin3ylidene)3(4methoxyphenethyl)2thioxothiazolidin4one
COC1=CC=C(C=C1)CCN2C(=O)C(=C3C4=C(C=CC(=C4)Br)NC3=O)SC2=S
COc1ccc(cc1)CCN1C(=S)SC(=C2C(=O)Nc3c2cc(Br)cc3)C1=O
InChI=1SC20H15BrN2O3S2c126135211(3613)892319(25)17(2820(23)27)16141012(21)4715(14)2218(16)24h2710H89H21H3(H2224)b1716+
MFCD04031811
ZINC000002394786
ZINC02394786
ZINC2394786
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