1-(N'-dodecylcarbamimidoyl)-2-(4-tridecoxyphenyl)sulfonyl-guanidine hydrochloride

Systemtic Name: 1-(N'-dodecylcarbamimidoyl)-2-(4-tridecoxyphenyl)sulfonyl-guanidine hydrochloride Openeye Name: 1-(N'-dodecylcarbamimidoyl)-2-(4-tridecoxyphenyl)sulfonyl-guanidine hydrochloride CAS Name: 1-[amino(dodecylimino)methyl]-2-(4-tridecoxyphenyl)sulfonylguanidine hydrochloride IUPAC Name: 1-(N'-dodecylcarbamimidoyl)-2-(4-tridecoxyphenyl)sulfonylguanidine hydrochloride Traditional Name: 1-(N'-laurylamidino)-2-(4-tridecoxyphenyl)sulfonyl-guanidine hydrochloride Formula: C33H62ClN5O3S MolecularWeight: 644.39508

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCOC1=CC=C(C=C1)S(=O)(=O)N=C(N)NC(=NCCCCCCCCCCCC)N.Cl

Isomeric SMILES

CCCCCCCCCCCCCOC1=CC=C(C=C1)S(=O)(=O)N=C(N)NC(=NCCCCCCCCCCCC)N.Cl

InChI

InChI=1S/C33H61N5O3S.ClH/c1-3-5-7-9-11-13-15-17-19-21-23-29-41-30-24-26-31(27-25-30)42(39,40)38-33(35)37-32(34)36-28-22-20-18-16-14-12-10-8-6-4-2;/h24-27H,3-23,28-29H2,1-2H3,(H5,34,35,36,37,38);1H