1-carbamimidoyl-3-hexyl-1-(3-pyridin-2-ylpropyl)urea

Systemtic Name: 1-carbamimidoyl-3-hexyl-1-(3-pyridin-2-ylpropyl)urea Openeye Name: 1-carbamimidoyl-3-hexyl-1-[3-(2-pyridyl)propyl]urea CAS Name: 1-carbamimidoyl-3-hexyl-1-[3-(2-pyridinyl)propyl]urea IUPAC Name: 1-carbamimidoyl-3-hexyl-1-(3-pyridin-2-ylpropyl)urea Traditional Name: 1-amidino-3-hexyl-1-[3-(2-pyridyl)propyl]urea Formula: C16H27N5O MolecularWeight: 305.41848

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)N(CCCC1=CC=CC=N1)C(=N)N

Isomeric SMILES

CCCCCCNC(=O)N(CCCC1=CC=CC=N1)C(=N)N

InChI

InChI=1S/C16H27N5O/c1-2-3-4-6-12-20-16(22)21(15(17)18)13-8-10-14-9-5-7-11-19-14/h5,7,9,11H,2-4,6,8,10,12-13H2,1H3,(H3,17,18)(H,20,22)