[2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethyl] 2-azanyl-4-(trifluoromethyl)benzoate

Systemtic Name: [2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethyl] 2-azanyl-4-(trifluoromethyl)benzoate Openeye Name: [2-[(3-cyano-2-thienyl)amino]-2-oxo-ethyl] 2-amino-4-(trifluoromethyl)benzoate CAS Name: 2-amino-4-(trifluoromethyl)benzoic acid [2-[(3-cyano-2-thiophenyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl] 2-amino-4-(trifluoromethyl)benzoate Traditional Name: 2-amino-4-(trifluoromethyl)benzoic acid [2-[(3-cyano-2-thienyl)amino]-2-keto-ethyl] ester Formula: C15H10F3N3O3S MolecularWeight: 369.31841

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(F)(F)F)N)C(=O)OCC(=O)NC2=C(C=CS2)C#N

Isomeric SMILES

C1=CC(=C(C=C1C(F)(F)F)N)C(=O)OCC(=O)NC2=C(C=CS2)C#N

InChI

InChI=1S/C15H10F3N3O3S/c16-15(17,18)9-1-2-10(11(20)5-9)14(23)24-7-12(22)21-13-8(6-19)3-4-25-13/h1-5H,7,20H2,(H,21,22)