[2,5-dimethyl-4-(phenylsulfonylamino)phenyl] thiocyanate

Systemtic Name: [2,5-dimethyl-4-(phenylsulfonylamino)phenyl] thiocyanate Openeye Name: [4-(benzenesulfonamido)-2,5-dimethyl-phenyl] thiocyanate CAS Name: thiocyanic acid [4-(benzenesulfonamido)-2,5-dimethylphenyl] ester IUPAC Name: [4-(benzenesulfonamido)-2,5-dimethylphenyl] thiocyanate Traditional Name: thiocyanic acid [4-(benzenesulfonamido)-2,5-dimethyl-phenyl] ester Formula: C15H14N2O2S2 MolecularWeight: 318.41386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1SC#N)C)NS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC1=CC(=C(C=C1SC#N)C)NS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C15H14N2O2S2/c1-11-9-15(20-10-16)12(2)8-14(11)17-21(18,19)13-6-4-3-5-7-13/h3-9,17H,1-2H3