[azanyl(2-azanylethylsulfanyl)methylidene]-(4-hydroxyphenyl)azanium sulfate

Systemtic Name: [azanyl(2-azanylethylsulfanyl)methylidene]-(4-hydroxyphenyl)azanium sulfate Openeye Name: [amino(2-aminoethylsulfanyl)methylene]-(4-hydroxyphenyl)ammonium sulfate CAS Name: [amino-(2-aminoethylthio)methylidene]-(4-hydroxyphenyl)ammonium sulfate IUPAC Name: [amino(2-aminoethylsulfanyl)methylidene]-(4-hydroxyphenyl)azanium sulfate Traditional Name: [amino-(2-aminoethylthio)methylene]-(4-hydroxyphenyl)ammonium sulfate Formula: C18H28N6O6S3 MolecularWeight: 520.64652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[NH+]=C(N)SCCN)O.C1=CC(=CC=C1[NH+]=C(N)SCCN)O.[O-]S(=O)(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1[NH+]=C(N)SCCN)O.C1=CC(=CC=C1[NH+]=C(N)SCCN)O.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/2C9H13N3OS.H2O4S/c2*10-5-6-14-9(11)12-7-1-3-8(13)4-2-7;1-5(2,3)4/h2*1-4,13H,5-6,10H2,(H2,11,12);(H2,1,2,3,4)