[1-[(3-cyanothiophen-2-yl)amino]-1-oxidanylidene-propan-2-yl] 2,6-bis(fluoranyl)benzoate

Systemtic Name: [1-[(3-cyanothiophen-2-yl)amino]-1-oxidanylidene-propan-2-yl] 2,6-bis(fluoranyl)benzoate Openeye Name: [2-[(3-cyano-2-thienyl)amino]-1-methyl-2-oxo-ethyl] 2,6-difluorobenzoate CAS Name: 2,6-difluorobenzoic acid [1-[(3-cyano-2-thiophenyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(3-cyanothiophen-2-yl)amino]-1-oxopropan-2-yl] 2,6-difluorobenzoate Traditional Name: 2,6-difluorobenzoic acid [2-[(3-cyano-2-thienyl)amino]-2-keto-1-methyl-ethyl] ester Formula: C15H10F2N2O3S MolecularWeight: 336.313306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CS1)C#N)OC(=O)C2=C(C=CC=C2F)F

Isomeric SMILES

CC(C(=O)NC1=C(C=CS1)C#N)OC(=O)C2=C(C=CC=C2F)F

InChI

InChI=1S/C15H10F2N2O3S/c1-8(13(20)19-14-9(7-18)5-6-23-14)22-15(21)12-10(16)3-2-4-11(12)17/h2-6,8H,1H3,(H,19,20)