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

Systemtic Name: 1-[(1S)-3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-oxidanylidene-1-phenyl-propyl]urea Openeye Name: [(1S)-3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-oxo-1-phenyl-propyl]urea CAS Name: [(1S)-3-[4-(2,3-dimethylphenyl)-1-piperazinyl]-3-oxo-1-phenylpropyl]urea IUPAC Name: [(1S)-3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-oxo-1-phenylpropyl]urea Traditional Name: [(1S)-3-[4-(2,3-dimethylphenyl)piperazino]-3-keto-1-phenyl-propyl]urea Formula: C22H28N4O2 MolecularWeight: 380.48332

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C[C@@H](C3=CC=CC=C3)NC(=O)N)C

InChI

InChI=1S/C22H28N4O2/c1-16-7-6-10-20(17(16)2)25-11-13-26(14-12-25)21(27)15-19(24-22(23)28)18-8-4-3-5-9-18/h3-10,19H,11-15H2,1-2H3,(H3,23,24,28)/t19-/m0/s1