(4-dimethylaminophenyl)methyl-ethyl-[(2R)-1-oxidanylidene-1-[(4-sulfamoylphenyl)amino]propan-2-yl]azanium

Systemtic Name: (4-dimethylaminophenyl)methyl-ethyl-[(2R)-1-oxidanylidene-1-[(4-sulfamoylphenyl)amino]propan-2-yl]azanium Openeye Name: (4-dimethylaminophenyl)methyl-ethyl-[(1R)-1-methyl-2-oxo-2-(4-sulfamoylanilino)ethyl]ammonium CAS Name: (4-dimethylaminophenyl)methyl-ethyl-[(2R)-1-oxo-1-(4-sulfamoylanilino)propan-2-yl]ammonium IUPAC Name: (4-dimethylaminophenyl)methyl-ethyl-[(2R)-1-oxo-1-(4-sulfamoylanilino)propan-2-yl]azanium Traditional Name: [4-(dimethylamino)benzyl]-ethyl-[(1R)-2-keto-1-methyl-2-(4-sulfamoylanilino)ethyl]ammonium Formula: C20H29N4O3S+ MolecularWeight: 405.53426

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H28N4O3S/c1-5-24(14-16-6-10-18(11-7-16)23(3)4)15(2)20(25)22-17-8-12-19(13-9-17)28(21,26)27/h6-13,15H,5,14H2,1-4H3,(H,22,25)(H2,21,26,27)/p+1/t15-/m1/s1