methyl-(methylaminosulfanylcarbonyl)-[2-(4-methylphenyl)-3-(sulfonylamino)propanoyl]-propyl-azanium

Systemtic Name: methyl-(methylaminosulfanylcarbonyl)-[2-(4-methylphenyl)-3-(sulfonylamino)propanoyl]-propyl-azanium Openeye Name: methyl-(methylaminosulfanylcarbonyl)-propyl-[2-(p-tolyl)-3-(sulfonylamino)propanoyl]ammonium CAS Name: methyl-[(methylaminothio)-oxomethyl]-[2-(4-methylphenyl)-1-oxo-3-(sulfonylamino)propyl]-propylammonium IUPAC Name: methyl-(methylaminosulfanylcarbonyl)-[2-(4-methylphenyl)-3-(sulfonylamino)propanoyl]-propylazanium Traditional Name: methyl-(methylaminothio)carbonyl-propyl-[2-(p-tolyl)-3-(sulfonylamino)propanoyl]ammonium Formula: C16H24N3O4S2+ MolecularWeight: 386.50946

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+](C)(C(=O)C(CN=S(=O)=O)C1=CC=C(C=C1)C)C(=O)SNC

Isomeric SMILES

CCC[N+](C)(C(=O)C(CN=S(=O)=O)C1=CC=C(C=C1)C)C(=O)SNC

InChI

InChI=1S/C16H24N3O4S2/c1-5-10-19(4,16(21)24-17-3)15(20)14(11-18-25(22)23)13-8-6-12(2)7-9-13/h6-9,14,17H,5,10-11H2,1-4H3/q+1