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

Systemtic Name: 1-[2-(azepan-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]-3-(3-phenylpropyl)urea Openeye Name: 1-[2-(azepan-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]-3-(3-phenylpropyl)urea CAS Name: 1-[2-(1-azepanyl)-2-(1-methyl-2-pyrrolyl)ethyl]-3-(3-phenylpropyl)urea IUPAC Name: 1-[2-(azepan-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]-3-(3-phenylpropyl)urea Traditional Name: 1-[2-(azepan-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]-3-(3-phenylpropyl)urea Formula: C23H34N4O MolecularWeight: 382.54226

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(CNC(=O)NCCCC2=CC=CC=C2)N3CCCCCC3

Isomeric SMILES

CN1C=CC=C1C(CNC(=O)NCCCC2=CC=CC=C2)N3CCCCCC3

InChI

InChI=1S/C23H34N4O/c1-26-16-10-14-21(26)22(27-17-7-2-3-8-18-27)19-25-23(28)24-15-9-13-20-11-5-4-6-12-20/h4-6,10-12,14,16,22H,2-3,7-9,13,15,17-19H2,1H3,(H2,24,25,28)