methyl 2-acetamido-2-[(3-cyano-4-ethyl-5-methyl-thiophen-2-yl)amino]-3,3,3-tris(fluoranyl)propanoate

Systemtic Name: methyl 2-acetamido-2-[(3-cyano-4-ethyl-5-methyl-thiophen-2-yl)amino]-3,3,3-tris(fluoranyl)propanoate Openeye Name: methyl 2-acetamido-2-[(3-cyano-4-ethyl-5-methyl-2-thienyl)amino]-3,3,3-trifluoro-propanoate CAS Name: 2-acetamido-2-[(3-cyano-4-ethyl-5-methyl-2-thiophenyl)amino]-3,3,3-trifluoropropanoic acid methyl ester IUPAC Name: methyl 2-acetamido-2-[(3-cyano-4-ethyl-5-methylthiophen-2-yl)amino]-3,3,3-trifluoropropanoate Traditional Name: 2-acetamido-2-[(3-cyano-4-ethyl-5-methyl-2-thienyl)amino]-3,3,3-trifluoro-propionic acid methyl ester Formula: C14H16F3N3O3S MolecularWeight: 363.35535

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C#N)NC(C(=O)OC)(C(F)(F)F)NC(=O)C)C

Isomeric SMILES

CCC1=C(SC(=C1C#N)NC(C(=O)OC)(C(F)(F)F)NC(=O)C)C

InChI

InChI=1S/C14H16F3N3O3S/c1-5-9-7(2)24-11(10(9)6-18)20-13(12(22)23-4,14(15,16)17)19-8(3)21/h20H,5H2,1-4H3,(H,19,21)