1-[3-oxidanylidene-1-phenyl-3-[4-(phenylmethyl)-1,4-diazepan-1-yl]propyl]urea

Systemtic Name: 1-[3-oxidanylidene-1-phenyl-3-[4-(phenylmethyl)-1,4-diazepan-1-yl]propyl]urea Openeye Name: [3-(4-benzyl-1,4-diazepan-1-yl)-3-oxo-1-phenyl-propyl]urea CAS Name: [3-oxo-1-phenyl-3-[4-(phenylmethyl)-1,4-diazepan-1-yl]propyl]urea IUPAC Name: [3-(4-benzyl-1,4-diazepan-1-yl)-3-oxo-1-phenylpropyl]urea Traditional Name: [3-(4-benzyl-1,4-diazepan-1-yl)-3-keto-1-phenyl-propyl]urea Formula: C22H28N4O2 MolecularWeight: 380.48332

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)CC(C2=CC=CC=C2)NC(=O)N)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN(C1)C(=O)CC(C2=CC=CC=C2)NC(=O)N)CC3=CC=CC=C3

InChI

InChI=1S/C22H28N4O2/c23-22(28)24-20(19-10-5-2-6-11-19)16-21(27)26-13-7-12-25(14-15-26)17-18-8-3-1-4-9-18/h1-6,8-11,20H,7,12-17H2,(H3,23,24,28)