[3-methyl-4-[(1,3,5-trimethylpyrazol-4-yl)sulfonylamino]phenyl] thiocyanate

Systemtic Name: [3-methyl-4-[(1,3,5-trimethylpyrazol-4-yl)sulfonylamino]phenyl] thiocyanate Openeye Name: [3-methyl-4-[(1,3,5-trimethylpyrazol-4-yl)sulfonylamino]phenyl] thiocyanate CAS Name: thiocyanic acid [3-methyl-4-[(1,3,5-trimethyl-4-pyrazolyl)sulfonylamino]phenyl] ester IUPAC Name: [3-methyl-4-[(1,3,5-trimethylpyrazol-4-yl)sulfonylamino]phenyl] thiocyanate Traditional Name: thiocyanic acid [3-methyl-4-[(1,3,5-trimethylpyrazol-4-yl)sulfonylamino]phenyl] ester Formula: C14H16N4O2S2 MolecularWeight: 336.43244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)SC#N)NS(=O)(=O)C2=C(N(N=C2C)C)C

Isomeric SMILES

CC1=C(C=CC(=C1)SC#N)NS(=O)(=O)C2=C(N(N=C2C)C)C

InChI

InChI=1S/C14H16N4O2S2/c1-9-7-12(21-8-15)5-6-13(9)17-22(19,20)14-10(2)16-18(4)11(14)3/h5-7,17H,1-4H3