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

Systemtic Name: 1-cyclohexyl-3-[3-oxidanylidene-3-[4-(phenylmethyl)-1,4-diazepan-1-yl]propyl]urea Openeye Name: 1-[3-(4-benzyl-1,4-diazepan-1-yl)-3-oxo-propyl]-3-cyclohexyl-urea CAS Name: 1-cyclohexyl-3-[3-oxo-3-[4-(phenylmethyl)-1,4-diazepan-1-yl]propyl]urea IUPAC Name: 1-[3-(4-benzyl-1,4-diazepan-1-yl)-3-oxopropyl]-3-cyclohexylurea Traditional Name: 1-[3-(4-benzyl-1,4-diazepan-1-yl)-3-keto-propyl]-3-cyclohexyl-urea Formula: C22H34N4O2 MolecularWeight: 386.53096

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)NCCC(=O)N2CCCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)NC(=O)NCCC(=O)N2CCCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H34N4O2/c27-21(12-13-23-22(28)24-20-10-5-2-6-11-20)26-15-7-14-25(16-17-26)18-19-8-3-1-4-9-19/h1,3-4,8-9,20H,2,5-7,10-18H2,(H2,23,24,28)