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

Systemtic Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-5-oxidanylidene-1-[[3-(trifluoromethyl)phenyl]methyl]pyrrolidine-3-carboxamide Openeye Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-5-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]pyrrolidine-3-carboxamide CAS Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-5-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]-3-pyrrolidinecarboxamide IUPAC Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-5-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]pyrrolidine-3-carboxamide Traditional Name: 5-keto-N-(6-methoxy-1,3-benzothiazol-2-yl)-1-[3-(trifluoromethyl)benzyl]pyrrolidine-3-carboxamide Formula: C21H18F3N3O3S MolecularWeight: 449.44613

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CC(=O)N(C3)CC4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CC(=O)N(C3)CC4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C21H18F3N3O3S/c1-30-15-5-6-16-17(9-15)31-20(25-16)26-19(29)13-8-18(28)27(11-13)10-12-3-2-4-14(7-12)21(22,23)24/h2-7,9,13H,8,10-11H2,1H3,(H,25,26,29)