methyl 9-oxidanylidene-9-[[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]amino]nonanoate

Systemtic Name: methyl 9-oxidanylidene-9-[[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]amino]nonanoate Openeye Name: methyl 9-oxo-9-[[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]amino]nonanoate CAS Name: 9-oxo-9-[[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]amino]nonanoic acid methyl ester IUPAC Name: methyl 9-oxo-9-[[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]amino]nonanoate Traditional Name: 9-keto-9-[[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]amino]pelargonic acid methyl ester Formula: C13H18F3N3O3S MolecularWeight: 353.36053

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCCCC(=O)NC1=NN=C(S1)C(F)(F)F

Isomeric SMILES

COC(=O)CCCCCCCC(=O)NC1=NN=C(S1)C(F)(F)F

InChI

InChI=1S/C13H18F3N3O3S/c1-22-10(21)8-6-4-2-3-5-7-9(20)17-12-19-18-11(23-12)13(14,15)16/h2-8H2,1H3,(H,17,19,20)