1-[2-(azepan-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]-3-(4-fluorophenyl)urea

Systemtic Name: 1-[2-(azepan-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]-3-(4-fluorophenyl)urea Openeye Name: 1-[2-(azepan-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]-3-(4-fluorophenyl)urea CAS Name: 1-[2-(1-azepanyl)-2-(1-methyl-2-pyrrolyl)ethyl]-3-(4-fluorophenyl)urea IUPAC Name: 1-[2-(azepan-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]-3-(4-fluorophenyl)urea Traditional Name: 1-[2-(azepan-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]-3-(4-fluorophenyl)urea Formula: C20H27FN4O MolecularWeight: 358.452983

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(CNC(=O)NC2=CC=C(C=C2)F)N3CCCCCC3

Isomeric SMILES

CN1C=CC=C1C(CNC(=O)NC2=CC=C(C=C2)F)N3CCCCCC3

InChI

InChI=1S/C20H27FN4O/c1-24-12-6-7-18(24)19(25-13-4-2-3-5-14-25)15-22-20(26)23-17-10-8-16(21)9-11-17/h6-12,19H,2-5,13-15H2,1H3,(H2,22,23,26)