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4-(2,5-dimethylphenyl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperazine-1-carbothioamide

4-(2,5-dimethylphenyl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperazine-1-carbothioamide

Systemtic Name:4-(2,5-dimethylphenyl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperazine-1-carbothioamide
Openeye Name:4-(2,5-dimethylphenyl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperazine-1-carbothioamide
CAS Name:4-(2,5-dimethylphenyl)-N-[4-(2-pyrimidinylsulfamoyl)phenyl]-1-piperazinecarbothioamide
IUPAC Name:4-(2,5-dimethylphenyl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperazine-1-carbothioamide
Traditional Name:4-(2,5-dimethylphenyl)-N-[4-(2-pyrimidylsulfamoyl)phenyl]piperazine-1-carbothioamide
Formula: C23H26N6O2S2
MolecularWeight: 482.62154
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=S)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4


Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=S)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4


InChI

InChI=1S/C23H26N6O2S2/c1-17-4-5-18(2)21(16-17)28-12-14-29(15-13-28)23(32)26-19-6-8-20(9-7-19)33(30,31)27-22-24-10-3-11-25-22/h3-11,16H,12-15H2,1-2H3,(H,26,32)(H,24,25,27)


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