2-[[4-(4-methylphenyl)carbonylpiperazin-1-yl]methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[4-(4-methylphenyl)carbonylpiperazin-1-yl]methyl]-1H-quinazolin-4-one Openeye Name: 2-[[4-(4-methylbenzoyl)piperazin-1-yl]methyl]-1H-quinazolin-4-one CAS Name: 2-[[4-[(4-methylphenyl)-oxomethyl]-1-piperazinyl]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[4-(4-methylbenzoyl)piperazin-1-yl]methyl]-1H-quinazolin-4-one Traditional Name: 2-[(4-p-toluoylpiperazino)methyl]-1H-quinazolin-4-one Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)CC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)CC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C21H22N4O2/c1-15-6-8-16(9-7-15)21(27)25-12-10-24(11-13-25)14-19-22-18-5-3-2-4-17(18)20(26)23-19/h2-9H,10-14H2,1H3,(H,22,23,26)