2-[[4-(3-methylphenyl)carbonylpiperazin-1-yl]methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[4-(3-methylphenyl)carbonylpiperazin-1-yl]methyl]-1H-quinazolin-4-one Openeye Name: 2-[[4-(3-methylbenzoyl)piperazin-1-yl]methyl]-1H-quinazolin-4-one CAS Name: 2-[[4-[(3-methylphenyl)-oxomethyl]-1-piperazinyl]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[4-(3-methylbenzoyl)piperazin-1-yl]methyl]-1H-quinazolin-4-one Traditional Name: 2-[(4-m-toluoylpiperazino)methyl]-1H-quinazolin-4-one Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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