methyl-[(4-methylsulfanylphenyl)methyl]-[2-oxidanylidene-2-[(3-sulfamoylphenyl)amino]ethyl]azanium

Systemtic Name: methyl-[(4-methylsulfanylphenyl)methyl]-[2-oxidanylidene-2-[(3-sulfamoylphenyl)amino]ethyl]azanium Openeye Name: methyl-[(4-methylsulfanylphenyl)methyl]-[2-oxo-2-(3-sulfamoylanilino)ethyl]ammonium CAS Name: methyl-[[4-(methylthio)phenyl]methyl]-[2-oxo-2-(3-sulfamoylanilino)ethyl]ammonium IUPAC Name: methyl-[(4-methylsulfanylphenyl)methyl]-[2-oxo-2-(3-sulfamoylanilino)ethyl]azanium Traditional Name: [2-keto-2-(3-sulfamoylanilino)ethyl]-methyl-[4-(methylthio)benzyl]ammonium Formula: C17H22N3O3S2+ MolecularWeight: 380.50488

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)SC)CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)SC)CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N

InChI

InChI=1S/C17H21N3O3S2/c1-20(11-13-6-8-15(24-2)9-7-13)12-17(21)19-14-4-3-5-16(10-14)25(18,22)23/h3-10H,11-12H2,1-2H3,(H,19,21)(H2,18,22,23)/p+1