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

Systemtic Name: 3-bromanyl-N-[1-[3-(4-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-N-(2-methylpropyl)benzamide Openeye Name: 3-bromo-N-[1-[3-(4-ethoxyphenyl)-4-oxo-quinazolin-2-yl]ethyl]-N-isobutyl-benzamide CAS Name: 3-bromo-N-[1-[3-(4-ethoxyphenyl)-4-oxo-2-quinazolinyl]ethyl]-N-(2-methylpropyl)benzamide IUPAC Name: 3-bromo-N-[1-[3-(4-ethoxyphenyl)-4-oxoquinazolin-2-yl]ethyl]-N-(2-methylpropyl)benzamide Traditional Name: 3-bromo-N-isobutyl-N-[1-(4-keto-3-p-phenetyl-quinazolin-2-yl)ethyl]benzamide Formula: C29H30BrN3O3 MolecularWeight: 548.4708

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H30BrN3O3/c1-5-36-24-15-13-23(14-16-24)33-27(31-26-12-7-6-11-25(26)29(33)35)20(4)32(18-19(2)3)28(34)21-9-8-10-22(30)17-21/h6-17,19-20H,5,18H2,1-4H3