[[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]diazenyl] 4-methylpiperazine-1-carbodithioate

Systemtic Name: [[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]diazenyl] 4-methylpiperazine-1-carbodithioate Openeye Name: [4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]azo 4-methylpiperazine-1-carbodithioate CAS Name: 4-methyl-1-piperazinecarbodithioic acid [4-[(4-methyl-2-pyrimidinyl)sulfamoyl]phenyl]azo ester IUPAC Name: [[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]diazenyl] 4-methylpiperazine-1-carbodithioate Traditional Name: 4-methylpiperazine-1-carbodithioic acid [4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]azo ester Formula: C17H21N7O2S3 MolecularWeight: 451.58934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)NS(=O)(=O)C2=CC=C(C=C2)N=NSC(=S)N3CCN(CC3)C

Isomeric SMILES

CC1=NC(=NC=C1)NS(=O)(=O)C2=CC=C(C=C2)N=NSC(=S)N3CCN(CC3)C

InChI

InChI=1S/C17H21N7O2S3/c1-13-7-8-18-16(19-13)21-29(25,26)15-5-3-14(4-6-15)20-22-28-17(27)24-11-9-23(2)10-12-24/h3-8H,9-12H2,1-2H3,(H,18,19,21)