2-methyl-3-[4-[4-(phenylmethyl)piperazin-1-yl]carbonylphenyl]quinazolin-4-one

Systemtic Name: 2-methyl-3-[4-[4-(phenylmethyl)piperazin-1-yl]carbonylphenyl]quinazolin-4-one Openeye Name: 3-[4-(4-benzylpiperazine-1-carbonyl)phenyl]-2-methyl-quinazolin-4-one CAS Name: 2-methyl-3-[4-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]phenyl]-4-quinazolinone IUPAC Name: 3-[4-(4-benzylpiperazine-1-carbonyl)phenyl]-2-methylquinazolin-4-one Traditional Name: 3-[4-(4-benzylpiperazine-1-carbonyl)phenyl]-2-methyl-quinazolin-4-one Formula: C27H26N4O2 MolecularWeight: 438.52094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C(=O)N4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C(=O)N4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C27H26N4O2/c1-20-28-25-10-6-5-9-24(25)27(33)31(20)23-13-11-22(12-14-23)26(32)30-17-15-29(16-18-30)19-21-7-3-2-4-8-21/h2-14H,15-19H2,1H3