4-(naphthalen-1-ylmethyl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperazine-1-carbothioamide

Systemtic Name: 4-(naphthalen-1-ylmethyl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperazine-1-carbothioamide Openeye Name: 4-(1-naphthylmethyl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperazine-1-carbothioamide CAS Name: 4-(1-naphthalenylmethyl)-N-[4-(2-pyrimidinylsulfamoyl)phenyl]-1-piperazinecarbothioamide IUPAC Name: 4-(naphthalen-1-ylmethyl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperazine-1-carbothioamide Traditional Name: 4-(1-naphthylmethyl)-N-[4-(2-pyrimidylsulfamoyl)phenyl]piperazine-1-carbothioamide Formula: C26H26N6O2S2 MolecularWeight: 518.65364

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC3=CC=CC=C32)C(=S)NC4=CC=C(C=C4)S(=O)(=O)NC5=NC=CC=N5

Isomeric SMILES

C1CN(CCN1CC2=CC=CC3=CC=CC=C32)C(=S)NC4=CC=C(C=C4)S(=O)(=O)NC5=NC=CC=N5

InChI

InChI=1S/C26H26N6O2S2/c33-36(34,30-25-27-13-4-14-28-25)23-11-9-22(10-12-23)29-26(35)32-17-15-31(16-18-32)19-21-7-3-6-20-5-1-2-8-24(20)21/h1-14H,15-19H2,(H,29,35)(H,27,28,30)