N-[1-[3-(3,4-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-N-(phenylmethyl)pentanamide

Systemtic Name: N-[1-[3-(3,4-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-N-(phenylmethyl)pentanamide Openeye Name: N-benzyl-N-[1-[3-(3,4-dimethylphenyl)-4-oxo-quinazolin-2-yl]propyl]pentanamide CAS Name: N-[1-[3-(3,4-dimethylphenyl)-4-oxo-2-quinazolinyl]propyl]-N-(phenylmethyl)pentanamide IUPAC Name: N-benzyl-N-[1-[3-(3,4-dimethylphenyl)-4-oxoquinazolin-2-yl]propyl]pentanamide Traditional Name: N-benzyl-N-[1-[3-(3,4-dimethylphenyl)-4-keto-quinazolin-2-yl]propyl]valeramide Formula: C31H35N3O2 MolecularWeight: 481.6285

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N(CC1=CC=CC=C1)C(CC)C2=NC3=CC=CC=C3C(=O)N2C4=CC(=C(C=C4)C)C

Isomeric SMILES

CCCCC(=O)N(CC1=CC=CC=C1)C(CC)C2=NC3=CC=CC=C3C(=O)N2C4=CC(=C(C=C4)C)C

InChI

InChI=1S/C31H35N3O2/c1-5-7-17-29(35)33(21-24-13-9-8-10-14-24)28(6-2)30-32-27-16-12-11-15-26(27)31(36)34(30)25-19-18-22(3)23(4)20-25/h8-16,18-20,28H,5-7,17,21H2,1-4H3