[azanyl(azanylsulfanyl)methylidene]-(1-phenylpropyl)azanium sulfate

Systemtic Name: [azanyl(azanylsulfanyl)methylidene]-(1-phenylpropyl)azanium sulfate Openeye Name: [amino(aminosulfanyl)methylene]-(1-phenylpropyl)ammonium sulfate CAS Name: [amino-(aminothio)methylidene]-(1-phenylpropyl)ammonium sulfate IUPAC Name: [amino(aminosulfanyl)methylidene]-(1-phenylpropyl)azanium sulfate Traditional Name: [amino-(aminothio)methylene]-(1-phenylpropyl)ammonium sulfate Formula: C20H32N6O4S3 MolecularWeight: 516.70088

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C10H15N3S.H2O4S/c2*1-2-9(13-10(11)14-12)8-6-4-3-5-7-8;1-5(2,3)4/h2*3-7,9H,2,12H2,1H3,(H2,11,13);(H2,1,2,3,4)