[2-[(2-fluorophenyl)methylamino]-2-oxidanylidene-ethyl] 4,5-dimethoxy-2-(thiophen-2-ylcarbonylamino)benzoate

Systemtic Name: [2-[(2-fluorophenyl)methylamino]-2-oxidanylidene-ethyl] 4,5-dimethoxy-2-(thiophen-2-ylcarbonylamino)benzoate Openeye Name: [2-[(2-fluorophenyl)methylamino]-2-oxo-ethyl] 4,5-dimethoxy-2-(thiophene-2-carbonylamino)benzoate CAS Name: 4,5-dimethoxy-2-[[oxo(thiophen-2-yl)methyl]amino]benzoic acid [2-[(2-fluorophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(2-fluorophenyl)methylamino]-2-oxoethyl] 4,5-dimethoxy-2-(thiophene-2-carbonylamino)benzoate Traditional Name: 4,5-dimethoxy-2-(2-thenoylamino)benzoic acid [2-[(2-fluorobenzyl)amino]-2-keto-ethyl] ester Formula: C23H21FN2O6S MolecularWeight: 472.486043

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OCC(=O)NCC2=CC=CC=C2F)NC(=O)C3=CC=CS3)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OCC(=O)NCC2=CC=CC=C2F)NC(=O)C3=CC=CS3)OC

InChI

InChI=1S/C23H21FN2O6S/c1-30-18-10-15(17(11-19(18)31-2)26-22(28)20-8-5-9-33-20)23(29)32-13-21(27)25-12-14-6-3-4-7-16(14)24/h3-11H,12-13H2,1-2H3,(H,25,27)(H,26,28)