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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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