1-[1-(3-bromophenyl)-3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-oxidanylidene-propyl]urea

Systemtic Name: 1-[1-(3-bromophenyl)-3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-oxidanylidene-propyl]urea Openeye Name: [1-(3-bromophenyl)-3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-oxo-propyl]urea CAS Name: [1-(3-bromophenyl)-3-[4-(2,3-dimethylphenyl)-1-piperazinyl]-3-oxopropyl]urea IUPAC Name: [1-(3-bromophenyl)-3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-oxopropyl]urea Traditional Name: [1-(3-bromophenyl)-3-[4-(2,3-dimethylphenyl)piperazino]-3-keto-propyl]urea Formula: C22H27BrN4O2 MolecularWeight: 459.37938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)CC(C3=CC(=CC=C3)Br)NC(=O)N)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)CC(C3=CC(=CC=C3)Br)NC(=O)N)C

InChI

InChI=1S/C22H27BrN4O2/c1-15-5-3-8-20(16(15)2)26-9-11-27(12-10-26)21(28)14-19(25-22(24)29)17-6-4-7-18(23)13-17/h3-8,13,19H,9-12,14H2,1-2H3,(H3,24,25,29)