1-[3-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-1-(3-methylphenyl)-3-oxidanylidene-propyl]urea

Systemtic Name: 1-[3-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-1-(3-methylphenyl)-3-oxidanylidene-propyl]urea Openeye Name: [3-[4-(azepane-1-carbonyl)-1-piperidyl]-1-(m-tolyl)-3-oxo-propyl]urea CAS Name: [3-[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]-1-(3-methylphenyl)-3-oxopropyl]urea IUPAC Name: [3-[4-(azepane-1-carbonyl)piperidin-1-yl]-1-(3-methylphenyl)-3-oxopropyl]urea Traditional Name: [3-[4-(azepane-1-carbonyl)piperidino]-3-keto-1-(m-tolyl)propyl]urea Formula: C23H34N4O3 MolecularWeight: 414.54106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(CC(=O)N2CCC(CC2)C(=O)N3CCCCCC3)NC(=O)N

Isomeric SMILES

CC1=CC(=CC=C1)C(CC(=O)N2CCC(CC2)C(=O)N3CCCCCC3)NC(=O)N

InChI

InChI=1S/C23H34N4O3/c1-17-7-6-8-19(15-17)20(25-23(24)30)16-21(28)26-13-9-18(10-14-26)22(29)27-11-4-2-3-5-12-27/h6-8,15,18,20H,2-5,9-14,16H2,1H3,(H3,24,25,30)