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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NCCN2CCCCCC2

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NCCN2CCCCCC2

InChI

InChI=1S/C16H25N3O/c1-14-7-6-8-15(13-14)18-16(20)17-9-12-19-10-4-2-3-5-11-19/h6-8,13H,2-5,9-12H2,1H3,(H2,17,18,20)