1-[2-(azepan-1-yl)ethyl]-3-(2-methylphenyl)urea

Systemtic Name: 1-[2-(azepan-1-yl)ethyl]-3-(2-methylphenyl)urea Openeye Name: 1-[2-(azepan-1-yl)ethyl]-3-(o-tolyl)urea CAS Name: 1-[2-(1-azepanyl)ethyl]-3-(2-methylphenyl)urea IUPAC Name: 1-[2-(azepan-1-yl)ethyl]-3-(2-methylphenyl)urea Traditional Name: 1-[2-(azepan-1-yl)ethyl]-3-(o-tolyl)urea Formula: C16H25N3O MolecularWeight: 275.3892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)NCCN2CCCCCC2

Isomeric SMILES

CC1=CC=CC=C1NC(=O)NCCN2CCCCCC2

InChI

InChI=1S/C16H25N3O/c1-14-8-4-5-9-15(14)18-16(20)17-10-13-19-11-6-2-3-7-12-19/h4-5,8-9H,2-3,6-7,10-13H2,1H3,(H2,17,18,20)