3-(4-bromophenyl)-1-[1-[3-(3,4-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-1-phenethyl-urea

Systemtic Name: 3-(4-bromophenyl)-1-[1-[3-(3,4-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-1-phenethyl-urea Openeye Name: 3-(4-bromophenyl)-1-[1-[3-(3,4-dimethylphenyl)-4-oxo-quinazolin-2-yl]ethyl]-1-phenethyl-urea CAS Name: 3-(4-bromophenyl)-1-[1-[3-(3,4-dimethylphenyl)-4-oxo-2-quinazolinyl]ethyl]-1-phenethylurea IUPAC Name: 3-(4-bromophenyl)-1-[1-[3-(3,4-dimethylphenyl)-4-oxoquinazolin-2-yl]ethyl]-1-phenethylurea Traditional Name: 3-(4-bromophenyl)-1-[1-[3-(3,4-dimethylphenyl)-4-keto-quinazolin-2-yl]ethyl]-1-phenethyl-urea Formula: C33H31BrN4O2 MolecularWeight: 595.52884

Click to see the large picture

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)NC5=CC=C(C=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)NC5=CC=C(C=C5)Br)C

InChI

InChI=1S/C33H31BrN4O2/c1-22-13-18-28(21-23(22)2)38-31(36-30-12-8-7-11-29(30)32(38)39)24(3)37(20-19-25-9-5-4-6-10-25)33(40)35-27-16-14-26(34)15-17-27/h4-18,21,24H,19-20H2,1-3H3,(H,35,40)