[azanyl(methylsulfanyl)methylidene]azanium; 4-methylbenzenesulfonate

Systemtic Name: [azanyl(methylsulfanyl)methylidene]azanium; 4-methylbenzenesulfonate Openeye Name: [amino(methylsulfanyl)methylene]ammonium; 4-methylbenzenesulfonate CAS Name: [amino-(methylthio)methylidene]ammonium; 4-methylbenzenesulfonate IUPAC Name: [amino(methylsulfanyl)methylidene]azanium; 4-methylbenzenesulfonate Traditional Name: [amino-(methylthio)methylene]ammonium tosylate Formula: C9H14N2O3S2 MolecularWeight: 262.34906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].CSC(=[NH2+])N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].CSC(=[NH2+])N

InChI

InChI=1S/C7H8O3S.C2H6N2S/c1-6-2-4-7(5-3-6)11(8,9)10;1-5-2(3)4/h2-5H,1H3,(H,8,9,10);1H3,(H3,3,4)