3-(4-methylphenyl)-2-[1-(2-oxidanylidenepyrrolidin-1-yl)-3-piperidin-1-yl-propan-2-yl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-(4-methylphenyl)-2-[1-(2-oxidanylidenepyrrolidin-1-yl)-3-piperidin-1-yl-propan-2-yl]sulfanyl-quinazolin-4-one Openeye Name: 2-[1-[(2-oxopyrrolidin-1-yl)methyl]-2-(1-piperidyl)ethyl]sulfanyl-3-(p-tolyl)quinazolin-4-one CAS Name: 3-(4-methylphenyl)-2-[[1-(2-oxo-1-pyrrolidinyl)-3-(1-piperidinyl)propan-2-yl]thio]-4-quinazolinone IUPAC Name: 3-(4-methylphenyl)-2-[1-(2-oxopyrrolidin-1-yl)-3-piperidin-1-ylpropan-2-yl]sulfanylquinazolin-4-one Traditional Name: 2-[[1-[(2-ketopyrrolidino)methyl]-2-piperidino-ethyl]thio]-3-(p-tolyl)quinazolin-4-one Formula: C27H32N4O2S MolecularWeight: 476.63358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC(CN4CCCCC4)CN5CCCC5=O

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC(CN4CCCCC4)CN5CCCC5=O

InChI

InChI=1S/C27H32N4O2S/c1-20-11-13-21(14-12-20)31-26(33)23-8-3-4-9-24(23)28-27(31)34-22(18-29-15-5-2-6-16-29)19-30-17-7-10-25(30)32/h3-4,8-9,11-14,22H,2,5-7,10,15-19H2,1H3