4-(phenylmethyl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperidine-1-carbothioamide

Systemtic Name: 4-(phenylmethyl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperidine-1-carbothioamide Openeye Name: 4-benzyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperidine-1-carbothioamide CAS Name: 4-(phenylmethyl)-N-[4-(2-pyrimidinylsulfamoyl)phenyl]-1-piperidinecarbothioamide IUPAC Name: 4-benzyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperidine-1-carbothioamide Traditional Name: 4-benzyl-N-[4-(2-pyrimidylsulfamoyl)phenyl]piperidine-1-carbothioamide Formula: C23H25N5O2S2 MolecularWeight: 467.6069

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(=S)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(=S)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4

InChI

InChI=1S/C23H25N5O2S2/c29-32(30,27-22-24-13-4-14-25-22)21-9-7-20(8-10-21)26-23(31)28-15-11-19(12-16-28)17-18-5-2-1-3-6-18/h1-10,13-14,19H,11-12,15-17H2,(H,26,31)(H,24,25,27)