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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2C(C)N(CCC(C)C)C(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2C(C)N(CCC(C)C)C(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C31H35N3O3/c1-6-37-26-17-15-25(16-18-26)34-29(32-28-10-8-7-9-27(28)31(34)36)23(5)33(20-19-21(2)3)30(35)24-13-11-22(4)12-14-24/h7-18,21,23H,6,19-20H2,1-5H3