[azanyl-[2-(methylamino)ethylsulfanyl]methylidene]-ethanoyl-azanium sulfate

Systemtic Name: [azanyl-[2-(methylamino)ethylsulfanyl]methylidene]-ethanoyl-azanium sulfate Openeye Name: acetyl-[amino-[2-(methylamino)ethylsulfanyl]methylene]ammonium sulfate CAS Name: acetyl-[amino-[2-(methylamino)ethylthio]methylidene]ammonium sulfate IUPAC Name: acetyl-[amino-[2-(methylamino)ethylsulfanyl]methylidene]azanium sulfate Traditional Name: acetyl-[amino-[2-(methylamino)ethylthio]methylene]ammonium sulfate Formula: C12H28N6O6S3 MolecularWeight: 448.58232

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)[NH+]=C(N)SCCNC.CC(=O)[NH+]=C(N)SCCNC.[O-]S(=O)(=O)[O-]

Isomeric SMILES

CC(=O)[NH+]=C(N)SCCNC.CC(=O)[NH+]=C(N)SCCNC.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/2C6H13N3OS.H2O4S/c2*1-5(10)9-6(7)11-4-3-8-2;1-5(2,3)4/h2*8H,3-4H2,1-2H3,(H2,7,9,10);(H2,1,2,3,4)