N-(2-methyl-1,3-benzothiazol-6-yl)-5-oxidanylidene-1-[[3-(trifluoromethyl)phenyl]methyl]pyrrolidine-3-carboxamide

Systemtic Name: N-(2-methyl-1,3-benzothiazol-6-yl)-5-oxidanylidene-1-[[3-(trifluoromethyl)phenyl]methyl]pyrrolidine-3-carboxamide Openeye Name: N-(2-methyl-1,3-benzothiazol-6-yl)-5-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]pyrrolidine-3-carboxamide CAS Name: N-(2-methyl-1,3-benzothiazol-6-yl)-5-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]-3-pyrrolidinecarboxamide IUPAC Name: N-(2-methyl-1,3-benzothiazol-6-yl)-5-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]pyrrolidine-3-carboxamide Traditional Name: 5-keto-N-(2-methyl-1,3-benzothiazol-6-yl)-1-[3-(trifluoromethyl)benzyl]pyrrolidine-3-carboxamide Formula: C21H18F3N3O2S MolecularWeight: 433.44673

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)NC(=O)C3CC(=O)N(C3)CC4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)NC(=O)C3CC(=O)N(C3)CC4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C21H18F3N3O2S/c1-12-25-17-6-5-16(9-18(17)30-12)26-20(29)14-8-19(28)27(11-14)10-13-3-2-4-15(7-13)21(22,23)24/h2-7,9,14H,8,10-11H2,1H3,(H,26,29)