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

Systemtic Name: [3-ethyl-4-[(1,3,5-trimethylpyrazol-4-yl)sulfonylamino]phenyl] thiocyanate Openeye Name: [3-ethyl-4-[(1,3,5-trimethylpyrazol-4-yl)sulfonylamino]phenyl] thiocyanate CAS Name: thiocyanic acid [3-ethyl-4-[(1,3,5-trimethyl-4-pyrazolyl)sulfonylamino]phenyl] ester IUPAC Name: [3-ethyl-4-[(1,3,5-trimethylpyrazol-4-yl)sulfonylamino]phenyl] thiocyanate Traditional Name: thiocyanic acid [3-ethyl-4-[(1,3,5-trimethylpyrazol-4-yl)sulfonylamino]phenyl] ester Formula: C15H18N4O2S2 MolecularWeight: 350.45902

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)SC#N)NS(=O)(=O)C2=C(N(N=C2C)C)C

Isomeric SMILES

CCC1=C(C=CC(=C1)SC#N)NS(=O)(=O)C2=C(N(N=C2C)C)C

InChI

InChI=1S/C15H18N4O2S2/c1-5-12-8-13(22-9-16)6-7-14(12)18-23(20,21)15-10(2)17-19(4)11(15)3/h6-8,18H,5H2,1-4H3