2-[9-(hydroxymethyl)heptadecan-9-yl]-2-oxidanyl-propanedithioamide

Systemtic Name: 2-[9-(hydroxymethyl)heptadecan-9-yl]-2-oxidanyl-propanedithioamide Openeye Name: 2-hydroxy-2-[1-(hydroxymethyl)-1-octyl-nonyl]propanedithioamide CAS Name: 2-hydroxy-2-[9-(hydroxymethyl)heptadecan-9-yl]propanedithioamide IUPAC Name: 2-hydroxy-2-[9-(hydroxymethyl)heptadecan-9-yl]propanedithioamide Traditional Name: 2-hydroxy-2-(1-methylol-1-octyl-nonyl)propanedithioamide Formula: C21H42N2O2S2 MolecularWeight: 418.70038

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CCCCCCCC)(CO)C(C(=S)N)(C(=S)N)O

Isomeric SMILES

CCCCCCCCC(CCCCCCCC)(CO)C(C(=S)N)(C(=S)N)O

InChI

InChI=1S/C21H42N2O2S2/c1-3-5-7-9-11-13-15-20(17-24,16-14-12-10-8-6-4-2)21(25,18(22)26)19(23)27/h24-25H,3-17H2,1-2H3,(H2,22,26)(H2,23,27)