[3,5-dimethyl-1-(4-methylphenyl)sulfonyl-pyrazol-4-yl] morpholine-4-carbodithioate

Systemtic Name: [3,5-dimethyl-1-(4-methylphenyl)sulfonyl-pyrazol-4-yl] morpholine-4-carbodithioate Openeye Name: [3,5-dimethyl-1-(p-tolylsulfonyl)pyrazol-4-yl] morpholine-4-carbodithioate CAS Name: 4-morpholinecarbodithioic acid [3,5-dimethyl-1-(4-methylphenyl)sulfonyl-4-pyrazolyl] ester IUPAC Name: [3,5-dimethyl-1-(4-methylphenyl)sulfonylpyrazol-4-yl] morpholine-4-carbodithioate Traditional Name: morpholine-4-carbodithioic acid (3,5-dimethyl-1-tosyl-pyrazol-4-yl) ester Formula: C17H21N3O3S3 MolecularWeight: 411.56194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(=C(C(=N2)C)SC(=S)N3CCOCC3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C(=C(C(=N2)C)SC(=S)N3CCOCC3)C

InChI

InChI=1S/C17H21N3O3S3/c1-12-4-6-15(7-5-12)26(21,22)20-14(3)16(13(2)18-20)25-17(24)19-8-10-23-11-9-19/h4-7H,8-11H2,1-3H3