1-carbamimidoyl-1-[3-(3-methylpyridin-2-yl)propyl]-3-pentyl-urea

Systemtic Name: 1-carbamimidoyl-1-[3-(3-methylpyridin-2-yl)propyl]-3-pentyl-urea Openeye Name: 1-carbamimidoyl-1-[3-(3-methyl-2-pyridyl)propyl]-3-pentyl-urea CAS Name: 1-carbamimidoyl-1-[3-(3-methyl-2-pyridinyl)propyl]-3-pentylurea IUPAC Name: 1-carbamimidoyl-1-[3-(3-methylpyridin-2-yl)propyl]-3-pentylurea Traditional Name: 1-amidino-3-amyl-1-[3-(3-methyl-2-pyridyl)propyl]urea Formula: C16H27N5O MolecularWeight: 305.41848

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H27N5O/c1-3-4-5-10-20-16(22)21(15(17)18)12-7-9-14-13(2)8-6-11-19-14/h6,8,11H,3-5,7,9-10,12H2,1-2H3,(H3,17,18)(H,20,22)