3-(2-bromophenyl)-1-butyl-1-[1-[3-(4-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]urea

Systemtic Name: 3-(2-bromophenyl)-1-butyl-1-[1-[3-(4-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]urea Openeye Name: 3-(2-bromophenyl)-1-butyl-1-[1-[3-(4-ethoxyphenyl)-4-oxo-quinazolin-2-yl]ethyl]urea CAS Name: 3-(2-bromophenyl)-1-butyl-1-[1-[3-(4-ethoxyphenyl)-4-oxo-2-quinazolinyl]ethyl]urea IUPAC Name: 3-(2-bromophenyl)-1-butyl-1-[1-[3-(4-ethoxyphenyl)-4-oxoquinazolin-2-yl]ethyl]urea Traditional Name: 3-(2-bromophenyl)-1-butyl-1-[1-(4-keto-3-p-phenetyl-quinazolin-2-yl)ethyl]urea Formula: C29H31BrN4O3 MolecularWeight: 563.48544

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C(C)C1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)OCC)C(=O)NC4=CC=CC=C4Br

Isomeric SMILES

CCCCN(C(C)C1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)OCC)C(=O)NC4=CC=CC=C4Br

InChI

InChI=1S/C29H31BrN4O3/c1-4-6-19-33(29(36)32-26-14-10-8-12-24(26)30)20(3)27-31-25-13-9-7-11-23(25)28(35)34(27)21-15-17-22(18-16-21)37-5-2/h7-18,20H,4-6,19H2,1-3H3,(H,32,36)