N-[3-[(3-chlorophenyl)methyl]-4-oxidanylidene-2-(phenylmethyl)quinazolin-6-yl]-3-phenyl-propanamide

Systemtic Name: N-[3-[(3-chlorophenyl)methyl]-4-oxidanylidene-2-(phenylmethyl)quinazolin-6-yl]-3-phenyl-propanamide Openeye Name: N-[2-benzyl-3-[(3-chlorophenyl)methyl]-4-oxo-quinazolin-6-yl]-3-phenyl-propanamide CAS Name: N-[3-[(3-chlorophenyl)methyl]-4-oxo-2-(phenylmethyl)-6-quinazolinyl]-3-phenylpropanamide IUPAC Name: N-[2-benzyl-3-[(3-chlorophenyl)methyl]-4-oxoquinazolin-6-yl]-3-phenylpropanamide Traditional Name: N-[2-benzyl-3-(3-chlorobenzyl)-4-keto-quinazolin-6-yl]-3-phenyl-propionamide Formula: C31H26ClN3O2 MolecularWeight: 508.01004

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(=O)NC2=CC3=C(C=C2)N=C(N(C3=O)CC4=CC(=CC=C4)Cl)CC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CCC(=O)NC2=CC3=C(C=C2)N=C(N(C3=O)CC4=CC(=CC=C4)Cl)CC5=CC=CC=C5

InChI

InChI=1S/C31H26ClN3O2/c32-25-13-7-12-24(18-25)21-35-29(19-23-10-5-2-6-11-23)34-28-16-15-26(20-27(28)31(35)37)33-30(36)17-14-22-8-3-1-4-9-22/h1-13,15-16,18,20H,14,17,19,21H2,(H,33,36)