3-methyl-1-oxidanylidene-N-[5-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-2-yl]-4H-isochromene-3-carboxamide

Systemtic Name: 3-methyl-1-oxidanylidene-N-[5-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-2-yl]-4H-isochromene-3-carboxamide Openeye Name: 3-methyl-1-oxo-N-[5-[[3-(trifluoromethyl)phenyl]methyl]thiazol-2-yl]isochromane-3-carboxamide CAS Name: 3-methyl-1-oxo-N-[5-[[3-(trifluoromethyl)phenyl]methyl]-2-thiazolyl]-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: 3-methyl-1-oxo-N-[5-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-2-yl]-4H-isochromene-3-carboxamide Traditional Name: 1-keto-3-methyl-N-[5-[3-(trifluoromethyl)benzyl]thiazol-2-yl]isochroman-3-carboxamide Formula: C22H17F3N2O3S MolecularWeight: 446.44219

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC=CC=C2C(=O)O1)C(=O)NC3=NC=C(S3)CC4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

CC1(CC2=CC=CC=C2C(=O)O1)C(=O)NC3=NC=C(S3)CC4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C22H17F3N2O3S/c1-21(11-14-6-2-3-8-17(14)18(28)30-21)19(29)27-20-26-12-16(31-20)10-13-5-4-7-15(9-13)22(23,24)25/h2-9,12H,10-11H2,1H3,(H,26,27,29)