6-[2-(prop-1-en-2-yloxymethoxy)-1-propyl-azepan-1-ium-1-yl]-1H-1,3,5-triazine-2,4-dithione

Systemtic Name: 6-[2-(prop-1-en-2-yloxymethoxy)-1-propyl-azepan-1-ium-1-yl]-1H-1,3,5-triazine-2,4-dithione Openeye Name: 6-[2-(isopropenyloxymethoxy)-1-propyl-azepan-1-ium-1-yl]-1H-1,3,5-triazine-2,4-dithione CAS Name: 6-[2-(1-methylethenoxymethoxy)-1-propyl-1-azepan-1-iumyl]-1H-1,3,5-triazine-2,4-dithione IUPAC Name: 6-[2-(prop-1-en-2-yloxymethoxy)-1-propylazepan-1-ium-1-yl]-1H-1,3,5-triazine-2,4-dithione Traditional Name: 6-[2-(isopropenyloxymethoxy)-1-propyl-azepan-1-ium-1-yl]-1H-s-triazine-2,4-dithione Formula: C16H27N4O2S2+ MolecularWeight: 371.54118

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+]1(CCCCCC1OCOC(=C)C)C2=NC(=S)NC(=S)N2

Isomeric SMILES

CCC[N+]1(CCCCCC1OCOC(=C)C)C2=NC(=S)NC(=S)N2

InChI

InChI=1S/C16H26N4O2S2/c1-4-9-20(14-17-15(23)19-16(24)18-14)10-7-5-6-8-13(20)22-11-21-12(2)3/h13H,2,4-11H2,1,3H3,(H-,17,18,19,23,24)/p+1