7-chloranyl-2-[1-(4-methylphenyl)carbonylpiperidin-2-yl]-3-(phenylmethyl)quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[1-(4-methylphenyl)carbonylpiperidin-2-yl]-3-(phenylmethyl)quinazolin-4-one Openeye Name: 3-benzyl-7-chloro-2-[1-(4-methylbenzoyl)-2-piperidyl]quinazolin-4-one CAS Name: 7-chloro-2-[1-[(4-methylphenyl)-oxomethyl]-2-piperidinyl]-3-(phenylmethyl)-4-quinazolinone IUPAC Name: 3-benzyl-7-chloro-2-[1-(4-methylbenzoyl)piperidin-2-yl]quinazolin-4-one Traditional Name: 3-benzyl-7-chloro-2-(1-p-toluoyl-2-piperidyl)quinazolin-4-one Formula: C28H26ClN3O2 MolecularWeight: 471.97794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCCCC2C3=NC4=C(C=CC(=C4)Cl)C(=O)N3CC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCCCC2C3=NC4=C(C=CC(=C4)Cl)C(=O)N3CC5=CC=CC=C5

InChI

InChI=1S/C28H26ClN3O2/c1-19-10-12-21(13-11-19)27(33)31-16-6-5-9-25(31)26-30-24-17-22(29)14-15-23(24)28(34)32(26)18-20-7-3-2-4-8-20/h2-4,7-8,10-15,17,25H,5-6,9,16,18H2,1H3