N-[1-[3-(4-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-N-hexyl-benzamide

Systemtic Name: N-[1-[3-(4-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-N-hexyl-benzamide Openeye Name: N-[1-[3-(4-ethoxyphenyl)-4-oxo-quinazolin-2-yl]ethyl]-N-hexyl-benzamide CAS Name: N-[1-[3-(4-ethoxyphenyl)-4-oxo-2-quinazolinyl]ethyl]-N-hexylbenzamide IUPAC Name: N-[1-[3-(4-ethoxyphenyl)-4-oxoquinazolin-2-yl]ethyl]-N-hexylbenzamide Traditional Name: N-hexyl-N-[1-(4-keto-3-p-phenetyl-quinazolin-2-yl)ethyl]benzamide Formula: C31H35N3O3 MolecularWeight: 497.6279

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(C(C)C1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)OCC)C(=O)C4=CC=CC=C4

Isomeric SMILES

CCCCCCN(C(C)C1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)OCC)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C31H35N3O3/c1-4-6-7-13-22-33(30(35)24-14-9-8-10-15-24)23(3)29-32-28-17-12-11-16-27(28)31(36)34(29)25-18-20-26(21-19-25)37-5-2/h8-12,14-21,23H,4-7,13,22H2,1-3H3