methyl 2-[2,2,2-tris(fluoranyl)ethanoylamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: methyl 2-[2,2,2-tris(fluoranyl)ethanoylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 2-[(2,2,2-trifluoroacetyl)amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[(2,2,2-trifluoro-1-oxoethyl)amino]-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-[(2,2,2-trifluoroacetyl)amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[(2,2,2-trifluoroacetyl)amino]-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C11H7F3N2O3S MolecularWeight: 304.24509

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C(F)(F)F

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C(F)(F)F

InChI

InChI=1S/C11H7F3N2O3S/c1-19-8(17)5-2-3-6-7(4-5)20-10(15-6)16-9(18)11(12,13)14/h2-4H,1H3,(H,15,16,18)