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

Systemtic Name: [4-methyl-2-[[4-[3-(trifluoromethyl)phenyl]sulfanylphenyl]carbamoyl]pyridin-3-yl] butanoate Openeye Name: [4-methyl-2-[[4-[3-(trifluoromethyl)phenyl]sulfanylphenyl]carbamoyl]-3-pyridyl] butanoate CAS Name: butanoic 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] butanoate Traditional Name: butyric acid [4-methyl-2-[[4-[[3-(trifluoromethyl)phenyl]thio]phenyl]carbamoyl]-3-pyridyl] ester Formula: C24H21F3N2O3S MolecularWeight: 474.49535

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=C(C=CN=C1C(=O)NC2=CC=C(C=C2)SC3=CC=CC(=C3)C(F)(F)F)C

Isomeric SMILES

CCCC(=O)OC1=C(C=CN=C1C(=O)NC2=CC=C(C=C2)SC3=CC=CC(=C3)C(F)(F)F)C

InChI

InChI=1S/C24H21F3N2O3S/c1-3-5-20(30)32-22-15(2)12-13-28-21(22)23(31)29-17-8-10-18(11-9-17)33-19-7-4-6-16(14-19)24(25,26)27/h4,6-14H,3,5H2,1-2H3,(H,29,31)