[[4-(pyrimidin-2-ylsulfamoyl)phenyl]diazenyl] 4-methylpiperazine-1-carbodithioate

Systemtic Name: [[4-(pyrimidin-2-ylsulfamoyl)phenyl]diazenyl] 4-methylpiperazine-1-carbodithioate Openeye Name: [4-(pyrimidin-2-ylsulfamoyl)phenyl]azo 4-methylpiperazine-1-carbodithioate CAS Name: 4-methyl-1-piperazinecarbodithioic acid [4-(2-pyrimidinylsulfamoyl)phenyl]azo ester IUPAC Name: [[4-(pyrimidin-2-ylsulfamoyl)phenyl]diazenyl] 4-methylpiperazine-1-carbodithioate Traditional Name: 4-methylpiperazine-1-carbodithioic acid [4-(2-pyrimidylsulfamoyl)phenyl]azo ester Formula: C16H19N7O2S3 MolecularWeight: 437.56276

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=S)SN=NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3

Isomeric SMILES

CN1CCN(CC1)C(=S)SN=NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3

InChI

InChI=1S/C16H19N7O2S3/c1-22-9-11-23(12-10-22)16(26)27-21-19-13-3-5-14(6-4-13)28(24,25)20-15-17-7-2-8-18-15/h2-8H,9-12H2,1H3,(H,17,18,20)