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

Systemtic Name: 4-butyl-N-[1-[3-(4-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-4-butyl-N-[1-[3-(4-ethylphenyl)-4-oxo-quinazolin-2-yl]propyl]benzamide CAS Name: 4-butyl-N-[1-[3-(4-ethylphenyl)-4-oxo-2-quinazolinyl]propyl]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-4-butyl-N-[1-[3-(4-ethylphenyl)-4-oxoquinazolin-2-yl]propyl]benzamide Traditional Name: N-benzyl-4-butyl-N-[1-[3-(4-ethylphenyl)-4-keto-quinazolin-2-yl]propyl]benzamide Formula: C37H39N3O2 MolecularWeight: 557.72446

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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)CC

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)CC

InChI

InChI=1S/C37H39N3O2/c1-4-7-13-28-18-22-30(23-19-28)36(41)39(26-29-14-9-8-10-15-29)34(6-3)35-38-33-17-12-11-16-32(33)37(42)40(35)31-24-20-27(5-2)21-25-31/h8-12,14-25,34H,4-7,13,26H2,1-3H3