[3-methyl-4-[(4-propan-2-ylphenyl)sulfonylamino]phenyl] thiocyanate

Systemtic Name: [3-methyl-4-[(4-propan-2-ylphenyl)sulfonylamino]phenyl] thiocyanate Openeye Name: [4-[(4-isopropylphenyl)sulfonylamino]-3-methyl-phenyl] thiocyanate CAS Name: thiocyanic acid [3-methyl-4-[(4-propan-2-ylphenyl)sulfonylamino]phenyl] ester IUPAC Name: [3-methyl-4-[(4-propan-2-ylphenyl)sulfonylamino]phenyl] thiocyanate Traditional Name: thiocyanic acid [3-methyl-4-(p-cumenylsulfonylamino)phenyl] ester Formula: C17H18N2O2S2 MolecularWeight: 346.46702

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O2S2/c1-12(2)14-4-7-16(8-5-14)23(20,21)19-17-9-6-15(22-11-18)10-13(17)3/h4-10,12,19H,1-3H3