3-(3-bromophenyl)-1-[1-(4-oxidanylidene-3-propyl-quinazolin-2-yl)ethyl]-1-(phenylmethyl)urea

Systemtic Name: 3-(3-bromophenyl)-1-[1-(4-oxidanylidene-3-propyl-quinazolin-2-yl)ethyl]-1-(phenylmethyl)urea Openeye Name: 1-benzyl-3-(3-bromophenyl)-1-[1-(4-oxo-3-propyl-quinazolin-2-yl)ethyl]urea CAS Name: 3-(3-bromophenyl)-1-[1-(4-oxo-3-propyl-2-quinazolinyl)ethyl]-1-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-(3-bromophenyl)-1-[1-(4-oxo-3-propylquinazolin-2-yl)ethyl]urea Traditional Name: 1-benzyl-3-(3-bromophenyl)-1-[1-(4-keto-3-propyl-quinazolin-2-yl)ethyl]urea Formula: C27H27BrN4O2 MolecularWeight: 519.43288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2N=C1C(C)N(CC3=CC=CC=C3)C(=O)NC4=CC(=CC=C4)Br

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2N=C1C(C)N(CC3=CC=CC=C3)C(=O)NC4=CC(=CC=C4)Br

InChI

InChI=1S/C27H27BrN4O2/c1-3-16-31-25(30-24-15-8-7-14-23(24)26(31)33)19(2)32(18-20-10-5-4-6-11-20)27(34)29-22-13-9-12-21(28)17-22/h4-15,17,19H,3,16,18H2,1-2H3,(H,29,34)