N'-cyclohexyl-N-(2-oxidanylsulfonothioyloxyethyl)propane-1,3-diamine hydrate

Systemtic Name: N'-cyclohexyl-N-(2-oxidanylsulfonothioyloxyethyl)propane-1,3-diamine hydrate Openeye Name: N'-cyclohexyl-N-(2-hydroxysulfonothioyloxyethyl)propane-1,3-diamine hydrate CAS Name: N'-cyclohexyl-N-(2-hydroxysulfonothioyloxyethyl)propane-1,3-diamine hydrate IUPAC Name: N'-cyclohexyl-N-(2-hydroxysulfonothioyloxyethyl)propane-1,3-diamine hydrate Traditional Name: cyclohexyl-[3-(2-hydroxysulfonothioyloxyethylamino)propyl]amine hydrate Formula: C11H26N2O4S2 MolecularWeight: 314.46514

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NCCCNCCOS(=O)(=S)O.O

Isomeric SMILES

C1CCC(CC1)NCCCNCCOS(=O)(=S)O.O

InChI

InChI=1S/C11H24N2O3S2.H2O/c14-18(15,17)16-10-9-12-7-4-8-13-11-5-2-1-3-6-11;/h11-13H,1-10H2,(H,14,15,17);1H2