3-bromanyl-N-butyl-N-[1-[3-(2-methoxy-5-methyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]benzamide

Systemtic Name: 3-bromanyl-N-butyl-N-[1-[3-(2-methoxy-5-methyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]benzamide Openeye Name: 3-bromo-N-butyl-N-[1-[3-(2-methoxy-5-methyl-phenyl)-4-oxo-quinazolin-2-yl]ethyl]benzamide CAS Name: 3-bromo-N-butyl-N-[1-[3-(2-methoxy-5-methylphenyl)-4-oxo-2-quinazolinyl]ethyl]benzamide IUPAC Name: 3-bromo-N-butyl-N-[1-[3-(2-methoxy-5-methylphenyl)-4-oxoquinazolin-2-yl]ethyl]benzamide Traditional Name: 3-bromo-N-butyl-N-[1-[4-keto-3-(2-methoxy-5-methyl-phenyl)quinazolin-2-yl]ethyl]benzamide Formula: C29H30BrN3O3 MolecularWeight: 548.4708

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C(C)C1=NC2=CC=CC=C2C(=O)N1C3=C(C=CC(=C3)C)OC)C(=O)C4=CC(=CC=C4)Br

Isomeric SMILES

CCCCN(C(C)C1=NC2=CC=CC=C2C(=O)N1C3=C(C=CC(=C3)C)OC)C(=O)C4=CC(=CC=C4)Br

InChI

InChI=1S/C29H30BrN3O3/c1-5-6-16-32(28(34)21-10-9-11-22(30)18-21)20(3)27-31-24-13-8-7-12-23(24)29(35)33(27)25-17-19(2)14-15-26(25)36-4/h7-15,17-18,20H,5-6,16H2,1-4H3