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

Systemtic Name: 3-[4-[4-(2,3-dimethylphenyl)piperazin-1-yl]carbonylphenyl]-2-methyl-quinazolin-4-one Openeye Name: 3-[4-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]phenyl]-2-methyl-quinazolin-4-one CAS Name: 3-[4-[[4-(2,3-dimethylphenyl)-1-piperazinyl]-oxomethyl]phenyl]-2-methyl-4-quinazolinone IUPAC Name: 3-[4-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]phenyl]-2-methylquinazolin-4-one Traditional Name: 3-[4-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]phenyl]-2-methyl-quinazolin-4-one Formula: C28H28N4O2 MolecularWeight: 452.54752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=CC=C(C=C3)N4C(=NC5=CC=CC=C5C4=O)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=CC=C(C=C3)N4C(=NC5=CC=CC=C5C4=O)C)C

InChI

InChI=1S/C28H28N4O2/c1-19-7-6-10-26(20(19)2)30-15-17-31(18-16-30)27(33)22-11-13-23(14-12-22)32-21(3)29-25-9-5-4-8-24(25)28(32)34/h4-14H,15-18H2,1-3H3