1-azanylethyl N'-heptyl-N-octyl-carbamimidothioate

Systemtic Name: 1-azanylethyl N'-heptyl-N-octyl-carbamimidothioate Openeye Name: 2-(1-aminoethyl)-3-heptyl-1-octyl-isothiourea CAS Name: N'-heptyl-N-octylcarbamimidothioic acid 1-aminoethyl ester IUPAC Name: 1-aminoethyl N'-heptyl-N-octylcarbamimidothioate Traditional Name: 2-(1-aminoethyl)-3-heptyl-1-octyl-isothiourea Formula: C18H39N3S MolecularWeight: 329.58736

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=NCCCCCCC)SC(C)N

Isomeric SMILES

CCCCCCCCNC(=NCCCCCCC)SC(C)N

InChI

InChI=1S/C18H39N3S/c1-4-6-8-10-12-14-16-21-18(22-17(3)19)20-15-13-11-9-7-5-2/h17H,4-16,19H2,1-3H3,(H,20,21)