methyl 5-[[[5-(4-fluorophenyl)thiophen-2-yl]carbonylamino]methyl]-2-methoxy-benzoate

Systemtic Name: methyl 5-[[[5-(4-fluorophenyl)thiophen-2-yl]carbonylamino]methyl]-2-methoxy-benzoate Openeye Name: methyl 5-[[[5-(4-fluorophenyl)thiophene-2-carbonyl]amino]methyl]-2-methoxy-benzoate CAS Name: 5-[[[[5-(4-fluorophenyl)-2-thiophenyl]-oxomethyl]amino]methyl]-2-methoxybenzoic acid methyl ester IUPAC Name: methyl 5-[[[5-(4-fluorophenyl)thiophene-2-carbonyl]amino]methyl]-2-methoxybenzoate Traditional Name: 5-[[[5-(4-fluorophenyl)thiophene-2-carbonyl]amino]methyl]-2-methoxy-benzoic acid methyl ester Formula: C21H18FNO4S MolecularWeight: 399.435323

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C2=CC=C(S2)C3=CC=C(C=C3)F)C(=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C2=CC=C(S2)C3=CC=C(C=C3)F)C(=O)OC

InChI

InChI=1S/C21H18FNO4S/c1-26-17-8-3-13(11-16(17)21(25)27-2)12-23-20(24)19-10-9-18(28-19)14-4-6-15(22)7-5-14/h3-11H,12H2,1-2H3,(H,23,24)