7-chloranyl-2-[4,4-dimethyl-1-[(4-methylphenyl)methyl]-5-oxidanylidene-pyrrolidin-2-yl]-3-(phenylmethyl)quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[4,4-dimethyl-1-[(4-methylphenyl)methyl]-5-oxidanylidene-pyrrolidin-2-yl]-3-(phenylmethyl)quinazolin-4-one Openeye Name: 3-benzyl-7-chloro-2-[4,4-dimethyl-5-oxo-1-(p-tolylmethyl)pyrrolidin-2-yl]quinazolin-4-one CAS Name: 7-chloro-2-[4,4-dimethyl-1-[(4-methylphenyl)methyl]-5-oxo-2-pyrrolidinyl]-3-(phenylmethyl)-4-quinazolinone IUPAC Name: 3-benzyl-7-chloro-2-[4,4-dimethyl-1-[(4-methylphenyl)methyl]-5-oxopyrrolidin-2-yl]quinazolin-4-one Traditional Name: 3-benzyl-7-chloro-2-[5-keto-4,4-dimethyl-1-(4-methylbenzyl)pyrrolidin-2-yl]quinazolin-4-one Formula: C29H28ClN3O2 MolecularWeight: 486.00452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(CC(C2=O)(C)C)C3=NC4=C(C=CC(=C4)Cl)C(=O)N3CC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(CC(C2=O)(C)C)C3=NC4=C(C=CC(=C4)Cl)C(=O)N3CC5=CC=CC=C5

InChI

InChI=1S/C29H28ClN3O2/c1-19-9-11-21(12-10-19)17-32-25(16-29(2,3)28(32)35)26-31-24-15-22(30)13-14-23(24)27(34)33(26)18-20-7-5-4-6-8-20/h4-15,25H,16-18H2,1-3H3