4-butyl-N-[1-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-N-(phenylmethyl)benzamide

Systemtic Name: 4-butyl-N-[1-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-4-butyl-N-[1-[4-oxo-3-(p-tolyl)quinazolin-2-yl]propyl]benzamide CAS Name: 4-butyl-N-[1-[3-(4-methylphenyl)-4-oxo-2-quinazolinyl]propyl]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-4-butyl-N-[1-[3-(4-methylphenyl)-4-oxoquinazolin-2-yl]propyl]benzamide Traditional Name: N-benzyl-4-butyl-N-[1-[4-keto-3-(p-tolyl)quinazolin-2-yl]propyl]benzamide Formula: C36H37N3O2 MolecularWeight: 543.69788

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)N(CC2=CC=CC=C2)C(CC)C3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)N(CC2=CC=CC=C2)C(CC)C3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)C

InChI

InChI=1S/C36H37N3O2/c1-4-6-12-27-19-21-29(22-20-27)35(40)38(25-28-13-8-7-9-14-28)33(5-2)34-37-32-16-11-10-15-31(32)36(41)39(34)30-23-17-26(3)18-24-30/h7-11,13-24,33H,4-6,12,25H2,1-3H3