[4-[(5-tert-butyl-2-methyl-phenyl)sulfonylamino]-3-fluoranyl-phenyl] thiocyanate

Systemtic Name: [4-[(5-tert-butyl-2-methyl-phenyl)sulfonylamino]-3-fluoranyl-phenyl] thiocyanate Openeye Name: [4-[(5-tert-butyl-2-methyl-phenyl)sulfonylamino]-3-fluoro-phenyl] thiocyanate CAS Name: thiocyanic acid [4-[(5-tert-butyl-2-methylphenyl)sulfonylamino]-3-fluorophenyl] ester IUPAC Name: [4-[(5-tert-butyl-2-methylphenyl)sulfonylamino]-3-fluorophenyl] thiocyanate Traditional Name: thiocyanic acid [4-[(5-tert-butyl-2-methyl-phenyl)sulfonylamino]-3-fluoro-phenyl] ester Formula: C18H19FN2O2S2 MolecularWeight: 378.484063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)(C)C)S(=O)(=O)NC2=C(C=C(C=C2)SC#N)F

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)(C)C)S(=O)(=O)NC2=C(C=C(C=C2)SC#N)F

InChI

InChI=1S/C18H19FN2O2S2/c1-12-5-6-13(18(2,3)4)9-17(12)25(22,23)21-16-8-7-14(24-11-20)10-15(16)19/h5-10,21H,1-4H3