methyl 1-[[3-(dimethylsulfamoyl)phenyl]carbamothioyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[[3-(dimethylsulfamoyl)phenyl]carbamothioyl]piperidine-4-carboxylate Openeye Name: methyl 1-[[3-(dimethylsulfamoyl)phenyl]carbamothioyl]piperidine-4-carboxylate CAS Name: 1-[[3-(dimethylsulfamoyl)anilino]-sulfanylidenemethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[[3-(dimethylsulfamoyl)phenyl]carbamothioyl]piperidine-4-carboxylate Traditional Name: 1-[[3-(dimethylsulfamoyl)phenyl]thiocarbamoyl]isonipecotic acid methyl ester Formula: C16H23N3O4S2 MolecularWeight: 385.50152

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC(=C1)NC(=S)N2CCC(CC2)C(=O)OC

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC(=C1)NC(=S)N2CCC(CC2)C(=O)OC

InChI

InChI=1S/C16H23N3O4S2/c1-18(2)25(21,22)14-6-4-5-13(11-14)17-16(24)19-9-7-12(8-10-19)15(20)23-3/h4-6,11-12H,7-10H2,1-3H3,(H,17,24)