methyl 2-[2-[2-(3-fluorophenyl)-1,3-thiazol-4-yl]ethylcarbamoyl]benzoate

Systemtic Name: methyl 2-[2-[2-(3-fluorophenyl)-1,3-thiazol-4-yl]ethylcarbamoyl]benzoate Openeye Name: methyl 2-[2-[2-(3-fluorophenyl)thiazol-4-yl]ethylcarbamoyl]benzoate CAS Name: 2-[[2-[2-(3-fluorophenyl)-4-thiazolyl]ethylamino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 2-[2-[2-(3-fluorophenyl)-1,3-thiazol-4-yl]ethylcarbamoyl]benzoate Traditional Name: 2-[2-[2-(3-fluorophenyl)thiazol-4-yl]ethylcarbamoyl]benzoic acid methyl ester Formula: C20H17FN2O3S MolecularWeight: 384.423983

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1C(=O)NCCC2=CSC(=N2)C3=CC(=CC=C3)F

Isomeric SMILES

COC(=O)C1=CC=CC=C1C(=O)NCCC2=CSC(=N2)C3=CC(=CC=C3)F

InChI

InChI=1S/C20H17FN2O3S/c1-26-20(25)17-8-3-2-7-16(17)18(24)22-10-9-15-12-27-19(23-15)13-5-4-6-14(21)11-13/h2-8,11-12H,9-10H2,1H3,(H,22,24)