N'-[(2S)-1-oxidanylsulfonothioyloxypropan-2-yl]propane-1,3-diamine hydrochloride

Systemtic Name: N'-[(2S)-1-oxidanylsulfonothioyloxypropan-2-yl]propane-1,3-diamine hydrochloride Openeye Name: N'-[(1S)-2-hydroxysulfonothioyloxy-1-methyl-ethyl]propane-1,3-diamine hydrochloride CAS Name: N'-[(2S)-1-hydroxysulfonothioyloxypropan-2-yl]propane-1,3-diamine hydrochloride IUPAC Name: N'-[(2S)-1-hydroxysulfonothioyloxypropan-2-yl]propane-1,3-diamine hydrochloride Traditional Name: 3-aminopropyl-[(1S)-2-hydroxysulfonothioyloxy-1-methyl-ethyl]amine hydrochloride Formula: C6H17ClN2O3S2 MolecularWeight: 264.79378

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Descriptors Computed from Structure

Canonical SMILES:

CC(COS(=O)(=S)O)NCCCN.Cl

Isomeric SMILES

C[C@@H](COS(=O)(=S)O)NCCCN.Cl

InChI

InChI=1S/C6H16N2O3S2.ClH/c1-6(8-4-2-3-7)5-11-13(9,10)12;/h6,8H,2-5,7H2,1H3,(H,9,10,12);1H/t6-;/m0./s1