1-[4-[2-(1-methylpyrrol-2-yl)azepan-1-yl]-4-oxidanylidene-butyl]urea

Systemtic Name: 1-[4-[2-(1-methylpyrrol-2-yl)azepan-1-yl]-4-oxidanylidene-butyl]urea Openeye Name: [4-[2-(1-methylpyrrol-2-yl)azepan-1-yl]-4-oxo-butyl]urea CAS Name: [4-[2-(1-methyl-2-pyrrolyl)-1-azepanyl]-4-oxobutyl]urea IUPAC Name: [4-[2-(1-methylpyrrol-2-yl)azepan-1-yl]-4-oxobutyl]urea Traditional Name: [4-keto-4-[2-(1-methylpyrrol-2-yl)azepan-1-yl]butyl]urea Formula: C16H26N4O2 MolecularWeight: 306.40324

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C2CCCCCN2C(=O)CCCNC(=O)N

Isomeric SMILES

CN1C=CC=C1C2CCCCCN2C(=O)CCCNC(=O)N

InChI

InChI=1S/C16H26N4O2/c1-19-11-6-8-13(19)14-7-3-2-4-12-20(14)15(21)9-5-10-18-16(17)22/h6,8,11,14H,2-5,7,9-10,12H2,1H3,(H3,17,18,22)