methyl 4-[[[5-(4-fluorophenyl)thiophen-2-yl]carbonyl-methyl-amino]methyl]benzoate

Systemtic Name: methyl 4-[[[5-(4-fluorophenyl)thiophen-2-yl]carbonyl-methyl-amino]methyl]benzoate Openeye Name: methyl 4-[[[5-(4-fluorophenyl)thiophene-2-carbonyl]-methyl-amino]methyl]benzoate CAS Name: 4-[[[[5-(4-fluorophenyl)-2-thiophenyl]-oxomethyl]-methylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[5-(4-fluorophenyl)thiophene-2-carbonyl]-methylamino]methyl]benzoate Traditional Name: 4-[[[5-(4-fluorophenyl)thiophene-2-carbonyl]-methyl-amino]methyl]benzoic acid methyl ester Formula: C21H18FNO3S MolecularWeight: 383.435923

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)C(=O)OC)C(=O)C2=CC=C(S2)C3=CC=C(C=C3)F

Isomeric SMILES

CN(CC1=CC=C(C=C1)C(=O)OC)C(=O)C2=CC=C(S2)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H18FNO3S/c1-23(13-14-3-5-16(6-4-14)21(25)26-2)20(24)19-12-11-18(27-19)15-7-9-17(22)10-8-15/h3-12H,13H2,1-2H3