3-(3-bromophenyl)-1-hexyl-1-[1-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]urea

Systemtic Name: 3-(3-bromophenyl)-1-hexyl-1-[1-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]urea Openeye Name: 3-(3-bromophenyl)-1-hexyl-1-[1-[4-oxo-3-(p-tolyl)quinazolin-2-yl]ethyl]urea CAS Name: 3-(3-bromophenyl)-1-hexyl-1-[1-[3-(4-methylphenyl)-4-oxo-2-quinazolinyl]ethyl]urea IUPAC Name: 3-(3-bromophenyl)-1-hexyl-1-[1-[3-(4-methylphenyl)-4-oxoquinazolin-2-yl]ethyl]urea Traditional Name: 3-(3-bromophenyl)-1-hexyl-1-[1-[4-keto-3-(p-tolyl)quinazolin-2-yl]ethyl]urea Formula: C30H33BrN4O2 MolecularWeight: 561.51262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(C(C)C1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C)C(=O)NC4=CC(=CC=C4)Br

Isomeric SMILES

CCCCCCN(C(C)C1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C)C(=O)NC4=CC(=CC=C4)Br

InChI

InChI=1S/C30H33BrN4O2/c1-4-5-6-9-19-34(30(37)32-24-12-10-11-23(31)20-24)22(3)28-33-27-14-8-7-13-26(27)29(36)35(28)25-17-15-21(2)16-18-25/h7-8,10-18,20,22H,4-6,9,19H2,1-3H3,(H,32,37)