N-[2-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]sulfanylethyl]-3-methyl-1-oxidanylidene-4H-isochromene-3-carboxamide

Systemtic Name: N-[2-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]sulfanylethyl]-3-methyl-1-oxidanylidene-4H-isochromene-3-carboxamide Openeye Name: N-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]sulfanyl]ethyl]-3-methyl-1-oxo-isochromane-3-carboxamide CAS Name: N-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]thio]ethyl]-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: N-[2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanylethyl]-3-methyl-1-oxo-4H-isochromene-3-carboxamide Traditional Name: N-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]thio]ethyl]-1-keto-3-methyl-isochroman-3-carboxamide Formula: C19H16ClF3N2O3S MolecularWeight: 444.85515

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC=CC=C2C(=O)O1)C(=O)NCCSC3=C(C=C(C=N3)C(F)(F)F)Cl

Isomeric SMILES

CC1(CC2=CC=CC=C2C(=O)O1)C(=O)NCCSC3=C(C=C(C=N3)C(F)(F)F)Cl

InChI

InChI=1S/C19H16ClF3N2O3S/c1-18(9-11-4-2-3-5-13(11)16(26)28-18)17(27)24-6-7-29-15-14(20)8-12(10-25-15)19(21,22)23/h2-5,8,10H,6-7,9H2,1H3,(H,24,27)