3-(4-methylphenyl)-2-[3-oxidanylidene-3-[4-(2-phenoxyethyl)piperazin-1-yl]propyl]quinazolin-4-one

Systemtic Name: 3-(4-methylphenyl)-2-[3-oxidanylidene-3-[4-(2-phenoxyethyl)piperazin-1-yl]propyl]quinazolin-4-one Openeye Name: 2-[3-oxo-3-[4-(2-phenoxyethyl)piperazin-1-yl]propyl]-3-(p-tolyl)quinazolin-4-one CAS Name: 3-(4-methylphenyl)-2-[3-oxo-3-[4-(2-phenoxyethyl)-1-piperazinyl]propyl]-4-quinazolinone IUPAC Name: 3-(4-methylphenyl)-2-[3-oxo-3-[4-(2-phenoxyethyl)piperazin-1-yl]propyl]quinazolin-4-one Traditional Name: 2-[3-keto-3-[4-(2-phenoxyethyl)piperazino]propyl]-3-(p-tolyl)quinazolin-4-one Formula: C30H32N4O3 MolecularWeight: 496.60008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NC3=CC=CC=C3C2=O)CCC(=O)N4CCN(CC4)CCOC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NC3=CC=CC=C3C2=O)CCC(=O)N4CCN(CC4)CCOC5=CC=CC=C5

InChI

InChI=1S/C30H32N4O3/c1-23-11-13-24(14-12-23)34-28(31-27-10-6-5-9-26(27)30(34)36)15-16-29(35)33-19-17-32(18-20-33)21-22-37-25-7-3-2-4-8-25/h2-14H,15-22H2,1H3