[2-azanylethylsulfanyl(ethylamino)methylidene]-ethyl-azanium sulfate

Systemtic Name: [2-azanylethylsulfanyl(ethylamino)methylidene]-ethyl-azanium sulfate Openeye Name: [2-aminoethylsulfanyl(ethylamino)methylene]-ethyl-ammonium sulfate CAS Name: [(2-aminoethylthio)-(ethylamino)methylidene]-ethylammonium sulfate IUPAC Name: [2-aminoethylsulfanyl(ethylamino)methylidene]-ethylazanium sulfate Traditional Name: [(2-aminoethylthio)-(ethylamino)methylene]-ethyl-ammonium sulfate Formula: C14H36N6O4S3 MolecularWeight: 448.66844

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=[NH+]CC)SCCN.CCNC(=[NH+]CC)SCCN.[O-]S(=O)(=O)[O-]

Isomeric SMILES

CCNC(=[NH+]CC)SCCN.CCNC(=[NH+]CC)SCCN.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/2C7H17N3S.H2O4S/c2*1-3-9-7(10-4-2)11-6-5-8;1-5(2,3)4/h2*3-6,8H2,1-2H3,(H,9,10);(H2,1,2,3,4)