2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-(phenylmethyl)quinazolin-4-one

Systemtic Name: 2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-(phenylmethyl)quinazolin-4-one Openeye Name: 3-benzyl-2-[4-(2,3-dimethylphenyl)piperazin-1-yl]quinazolin-4-one CAS Name: 2-[4-(2,3-dimethylphenyl)-1-piperazinyl]-3-(phenylmethyl)-4-quinazolinone IUPAC Name: 3-benzyl-2-[4-(2,3-dimethylphenyl)piperazin-1-yl]quinazolin-4-one Traditional Name: 3-benzyl-2-[4-(2,3-dimethylphenyl)piperazino]quinazolin-4-one Formula: C27H28N4O MolecularWeight: 424.53742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C3=NC4=CC=CC=C4C(=O)N3CC5=CC=CC=C5)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C3=NC4=CC=CC=C4C(=O)N3CC5=CC=CC=C5)C

InChI

InChI=1S/C27H28N4O/c1-20-9-8-14-25(21(20)2)29-15-17-30(18-16-29)27-28-24-13-7-6-12-23(24)26(32)31(27)19-22-10-4-3-5-11-22/h3-14H,15-19H2,1-2H3