[1-oxidanylidene-1-[[3-(trifluoromethyl)phenyl]amino]propan-2-yl] 1,3-benzothiazole-6-carboxylate

Systemtic Name: [1-oxidanylidene-1-[[3-(trifluoromethyl)phenyl]amino]propan-2-yl] 1,3-benzothiazole-6-carboxylate Openeye Name: [1-methyl-2-oxo-2-[3-(trifluoromethyl)anilino]ethyl] 1,3-benzothiazole-6-carboxylate CAS Name: 1,3-benzothiazole-6-carboxylic acid [1-oxo-1-[3-(trifluoromethyl)anilino]propan-2-yl] ester IUPAC Name: [1-oxo-1-[3-(trifluoromethyl)anilino]propan-2-yl] 1,3-benzothiazole-6-carboxylate Traditional Name: 1,3-benzothiazole-6-carboxylic acid [2-keto-1-methyl-2-[3-(trifluoromethyl)anilino]ethyl] ester Formula: C18H13F3N2O3S MolecularWeight: 394.36763

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)C(F)(F)F)OC(=O)C2=CC3=C(C=C2)N=CS3

Isomeric SMILES

CC(C(=O)NC1=CC=CC(=C1)C(F)(F)F)OC(=O)C2=CC3=C(C=C2)N=CS3

InChI

InChI=1S/C18H13F3N2O3S/c1-10(16(24)23-13-4-2-3-12(8-13)18(19,20)21)26-17(25)11-5-6-14-15(7-11)27-9-22-14/h2-10H,1H3,(H,23,24)