3-bromanyl-N-[1-[3-(3,4-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-N-phenethyl-benzamide

Systemtic Name: 3-bromanyl-N-[1-[3-(3,4-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-N-phenethyl-benzamide Openeye Name: 3-bromo-N-[1-[3-(3,4-dimethylphenyl)-4-oxo-quinazolin-2-yl]ethyl]-N-phenethyl-benzamide CAS Name: 3-bromo-N-[1-[3-(3,4-dimethylphenyl)-4-oxo-2-quinazolinyl]ethyl]-N-phenethylbenzamide IUPAC Name: 3-bromo-N-[1-[3-(3,4-dimethylphenyl)-4-oxoquinazolin-2-yl]ethyl]-N-phenethylbenzamide Traditional Name: 3-bromo-N-[1-[3-(3,4-dimethylphenyl)-4-keto-quinazolin-2-yl]ethyl]-N-phenethyl-benzamide Formula: C33H30BrN3O2 MolecularWeight: 580.5142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2C(C)N(CCC4=CC=CC=C4)C(=O)C5=CC(=CC=C5)Br)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2C(C)N(CCC4=CC=CC=C4)C(=O)C5=CC(=CC=C5)Br)C

InChI

InChI=1S/C33H30BrN3O2/c1-22-16-17-28(20-23(22)2)37-31(35-30-15-8-7-14-29(30)33(37)39)24(3)36(19-18-25-10-5-4-6-11-25)32(38)26-12-9-13-27(34)21-26/h4-17,20-21,24H,18-19H2,1-3H3