[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]diazenyl] 4-methylpiperazine-1-carbodithioate

Systemtic Name: [[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]diazenyl] 4-methylpiperazine-1-carbodithioate Openeye Name: [4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]azo 4-methylpiperazine-1-carbodithioate CAS Name: 4-methyl-1-piperazinecarbodithioic acid [4-[(4,6-dimethyl-2-pyrimidinyl)sulfamoyl]phenyl]azo ester IUPAC Name: [[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]diazenyl] 4-methylpiperazine-1-carbodithioate Traditional Name: 4-methylpiperazine-1-carbodithioic acid [4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]azo ester Formula: C18H23N7O2S3 MolecularWeight: 465.61592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)N=NSC(=S)N3CCN(CC3)C)C

Isomeric SMILES

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)N=NSC(=S)N3CCN(CC3)C)C

InChI

InChI=1S/C18H23N7O2S3/c1-13-12-14(2)20-17(19-13)22-30(26,27)16-6-4-15(5-7-16)21-23-29-18(28)25-10-8-24(3)9-11-25/h4-7,12H,8-11H2,1-3H3,(H,19,20,22)