1-[1-(3-bromophenyl)-3-oxidanylidene-3-(4-phenylpiperazin-1-yl)propyl]urea

Systemtic Name: 1-[1-(3-bromophenyl)-3-oxidanylidene-3-(4-phenylpiperazin-1-yl)propyl]urea Openeye Name: [1-(3-bromophenyl)-3-oxo-3-(4-phenylpiperazin-1-yl)propyl]urea CAS Name: [1-(3-bromophenyl)-3-oxo-3-(4-phenyl-1-piperazinyl)propyl]urea IUPAC Name: [1-(3-bromophenyl)-3-oxo-3-(4-phenylpiperazin-1-yl)propyl]urea Traditional Name: [1-(3-bromophenyl)-3-keto-3-(4-phenylpiperazino)propyl]urea Formula: C20H23BrN4O2 MolecularWeight: 431.32622

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)CC(C3=CC(=CC=C3)Br)NC(=O)N

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)CC(C3=CC(=CC=C3)Br)NC(=O)N

InChI

InChI=1S/C20H23BrN4O2/c21-16-6-4-5-15(13-16)18(23-20(22)27)14-19(26)25-11-9-24(10-12-25)17-7-2-1-3-8-17/h1-8,13,18H,9-12,14H2,(H3,22,23,27)