N-[3-(dimethylsulfamoyl)phenyl]-4-pyridin-2-yl-piperazine-1-carbothioamide

Systemtic Name: N-[3-(dimethylsulfamoyl)phenyl]-4-pyridin-2-yl-piperazine-1-carbothioamide Openeye Name: N-[3-(dimethylsulfamoyl)phenyl]-4-(2-pyridyl)piperazine-1-carbothioamide CAS Name: N-[3-(dimethylsulfamoyl)phenyl]-4-(2-pyridinyl)-1-piperazinecarbothioamide IUPAC Name: N-[3-(dimethylsulfamoyl)phenyl]-4-pyridin-2-ylpiperazine-1-carbothioamide Traditional Name: N-[3-(dimethylsulfamoyl)phenyl]-4-(2-pyridyl)piperazine-1-carbothioamide Formula: C18H23N5O2S2 MolecularWeight: 405.53752

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC(=C1)NC(=S)N2CCN(CC2)C3=CC=CC=N3

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC(=C1)NC(=S)N2CCN(CC2)C3=CC=CC=N3

InChI

InChI=1S/C18H23N5O2S2/c1-21(2)27(24,25)16-7-5-6-15(14-16)20-18(26)23-12-10-22(11-13-23)17-8-3-4-9-19-17/h3-9,14H,10-13H2,1-2H3,(H,20,26)