tert-butyl-[(2S)-1-[[5-(dimethylsulfamoyl)-2-methyl-phenyl]amino]-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: tert-butyl-[(2S)-1-[[5-(dimethylsulfamoyl)-2-methyl-phenyl]amino]-1-oxidanylidene-propan-2-yl]azanium Openeye Name: tert-butyl-[(1S)-2-[5-(dimethylsulfamoyl)-2-methyl-anilino]-1-methyl-2-oxo-ethyl]ammonium CAS Name: tert-butyl-[(2S)-1-[5-(dimethylsulfamoyl)-2-methylanilino]-1-oxopropan-2-yl]ammonium IUPAC Name: tert-butyl-[(2S)-1-[5-(dimethylsulfamoyl)-2-methylanilino]-1-oxopropan-2-yl]azanium Traditional Name: tert-butyl-[(1S)-2-[5-(dimethylsulfamoyl)-2-methyl-anilino]-2-keto-1-methyl-ethyl]ammonium Formula: C16H28N3O3S+ MolecularWeight: 342.47682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C)NC(=O)C(C)[NH2+]C(C)(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C)NC(=O)[C@H](C)[NH2+]C(C)(C)C

InChI

InChI=1S/C16H27N3O3S/c1-11-8-9-13(23(21,22)19(6)7)10-14(11)17-15(20)12(2)18-16(3,4)5/h8-10,12,18H,1-7H3,(H,17,20)/p+1/t12-/m0/s1