(5R)-5-[(4-methylsulfanylphenyl)methyl]-5-[3-oxidanylidene-3-(4-quinazolin-2-ylpiperazin-1-yl)propyl]pyrrolidin-2-one

Systemtic Name: (5R)-5-[(4-methylsulfanylphenyl)methyl]-5-[3-oxidanylidene-3-(4-quinazolin-2-ylpiperazin-1-yl)propyl]pyrrolidin-2-one Openeye Name: (5R)-5-[(4-methylsulfanylphenyl)methyl]-5-[3-oxo-3-(4-quinazolin-2-ylpiperazin-1-yl)propyl]pyrrolidin-2-one CAS Name: (5R)-5-[[4-(methylthio)phenyl]methyl]-5-[3-oxo-3-[4-(2-quinazolinyl)-1-piperazinyl]propyl]-2-pyrrolidinone IUPAC Name: (5R)-5-[(4-methylsulfanylphenyl)methyl]-5-[3-oxo-3-(4-quinazolin-2-ylpiperazin-1-yl)propyl]pyrrolidin-2-one Traditional Name: (5R)-5-[3-keto-3-(4-quinazolin-2-ylpiperazino)propyl]-5-[4-(methylthio)benzyl]-2-pyrrolidone Formula: C27H31N5O2S MolecularWeight: 489.63234

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CC2(CCC(=O)N2)CCC(=O)N3CCN(CC3)C4=NC5=CC=CC=C5C=N4

Isomeric SMILES

CSC1=CC=C(C=C1)C[C@@]2(CCC(=O)N2)CCC(=O)N3CCN(CC3)C4=NC5=CC=CC=C5C=N4

InChI

InChI=1S/C27H31N5O2S/c1-35-22-8-6-20(7-9-22)18-27(12-10-24(33)30-27)13-11-25(34)31-14-16-32(17-15-31)26-28-19-21-4-2-3-5-23(21)29-26/h2-9,19H,10-18H2,1H3,(H,30,33)/t27-/m1/s1