[4-methyl-2-[[4-[3-(trifluoromethyl)phenyl]sulfanylphenyl]carbamoyl]pyridin-3-yl] ethanoate

Systemtic Name: [4-methyl-2-[[4-[3-(trifluoromethyl)phenyl]sulfanylphenyl]carbamoyl]pyridin-3-yl] ethanoate Openeye Name: [4-methyl-2-[[4-[3-(trifluoromethyl)phenyl]sulfanylphenyl]carbamoyl]-3-pyridyl] acetate CAS Name: acetic acid [4-methyl-2-[oxo-[4-[[3-(trifluoromethyl)phenyl]thio]anilino]methyl]-3-pyridinyl] ester IUPAC Name: [4-methyl-2-[[4-[3-(trifluoromethyl)phenyl]sulfanylphenyl]carbamoyl]pyridin-3-yl] acetate Traditional Name: acetic acid [4-methyl-2-[[4-[[3-(trifluoromethyl)phenyl]thio]phenyl]carbamoyl]-3-pyridyl] ester Formula: C22H17F3N2O3S MolecularWeight: 446.44219

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC=C1)C(=O)NC2=CC=C(C=C2)SC3=CC=CC(=C3)C(F)(F)F)OC(=O)C

Isomeric SMILES

CC1=C(C(=NC=C1)C(=O)NC2=CC=C(C=C2)SC3=CC=CC(=C3)C(F)(F)F)OC(=O)C

InChI

InChI=1S/C22H17F3N2O3S/c1-13-10-11-26-19(20(13)30-14(2)28)21(29)27-16-6-8-17(9-7-16)31-18-5-3-4-15(12-18)22(23,24)25/h3-12H,1-2H3,(H,27,29)