1-(2,6-dimethylphenyl)-3-(N'-hexylcarbamimidoyl)urea hydrochloride

Systemtic Name: 1-(2,6-dimethylphenyl)-3-(N'-hexylcarbamimidoyl)urea hydrochloride Openeye Name: 1-(2,6-dimethylphenyl)-3-(N'-hexylcarbamimidoyl)urea hydrochloride CAS Name: 1-[amino(hexylimino)methyl]-3-(2,6-dimethylphenyl)urea hydrochloride IUPAC Name: 1-(2,6-dimethylphenyl)-3-(N'-hexylcarbamimidoyl)urea hydrochloride Traditional Name: 1-(2,6-dimethylphenyl)-3-(N'-hexylamidino)urea hydrochloride Formula: C16H27ClN4O MolecularWeight: 326.86478

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN=C(N)NC(=O)NC1=C(C=CC=C1C)C.Cl

Isomeric SMILES

CCCCCCN=C(N)NC(=O)NC1=C(C=CC=C1C)C.Cl

InChI

InChI=1S/C16H26N4O.ClH/c1-4-5-6-7-11-18-15(17)20-16(21)19-14-12(2)9-8-10-13(14)3;/h8-10H,4-7,11H2,1-3H3,(H4,17,18,19,20,21);1H