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

Systemtic Name: 1-[1-[3-(4-bromophenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-1-butyl-3-(phenylmethyl)urea Openeye Name: 3-benzyl-1-[1-[3-(4-bromophenyl)-4-oxo-quinazolin-2-yl]propyl]-1-butyl-urea CAS Name: 1-[1-[3-(4-bromophenyl)-4-oxo-2-quinazolinyl]propyl]-1-butyl-3-(phenylmethyl)urea IUPAC Name: 3-benzyl-1-[1-[3-(4-bromophenyl)-4-oxoquinazolin-2-yl]propyl]-1-butylurea Traditional Name: 3-benzyl-1-[1-[3-(4-bromophenyl)-4-keto-quinazolin-2-yl]propyl]-1-butyl-urea Formula: C29H31BrN4O2 MolecularWeight: 547.48604

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C(CC)C1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)Br)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

CCCCN(C(CC)C1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)Br)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C29H31BrN4O2/c1-3-5-19-33(29(36)31-20-21-11-7-6-8-12-21)26(4-2)27-32-25-14-10-9-13-24(25)28(35)34(27)23-17-15-22(30)16-18-23/h6-18,26H,3-5,19-20H2,1-2H3,(H,31,36)