[2-[(2-fluorophenyl)methylamino]-2-oxidanylidene-ethyl] 3-(thiophen-2-ylcarbonylamino)propanoate

Systemtic Name: [2-[(2-fluorophenyl)methylamino]-2-oxidanylidene-ethyl] 3-(thiophen-2-ylcarbonylamino)propanoate Openeye Name: [2-[(2-fluorophenyl)methylamino]-2-oxo-ethyl] 3-(thiophene-2-carbonylamino)propanoate CAS Name: 3-[[oxo(thiophen-2-yl)methyl]amino]propanoic acid [2-[(2-fluorophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(2-fluorophenyl)methylamino]-2-oxoethyl] 3-(thiophene-2-carbonylamino)propanoate Traditional Name: 3-(2-thenoylamino)propionic acid [2-[(2-fluorobenzyl)amino]-2-keto-ethyl] ester Formula: C17H17FN2O4S MolecularWeight: 364.391283

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC(=O)COC(=O)CCNC(=O)C2=CC=CS2)F

Isomeric SMILES

C1=CC=C(C(=C1)CNC(=O)COC(=O)CCNC(=O)C2=CC=CS2)F

InChI

InChI=1S/C17H17FN2O4S/c18-13-5-2-1-4-12(13)10-20-15(21)11-24-16(22)7-8-19-17(23)14-6-3-9-25-14/h1-6,9H,7-8,10-11H2,(H,19,23)(H,20,21)