methyl 2-[2-[2-(3-fluorophenyl)-4-methyl-1,3-thiazol-5-yl]ethylcarbamoyl]benzoate

Systemtic Name: methyl 2-[2-[2-(3-fluorophenyl)-4-methyl-1,3-thiazol-5-yl]ethylcarbamoyl]benzoate Openeye Name: methyl 2-[2-[2-(3-fluorophenyl)-4-methyl-thiazol-5-yl]ethylcarbamoyl]benzoate CAS Name: 2-[[2-[2-(3-fluorophenyl)-4-methyl-5-thiazolyl]ethylamino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 2-[2-[2-(3-fluorophenyl)-4-methyl-1,3-thiazol-5-yl]ethylcarbamoyl]benzoate Traditional Name: 2-[2-[2-(3-fluorophenyl)-4-methyl-thiazol-5-yl]ethylcarbamoyl]benzoic acid methyl ester Formula: C21H19FN2O3S MolecularWeight: 398.450563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC(=CC=C2)F)CCNC(=O)C3=CC=CC=C3C(=O)OC

Isomeric SMILES

CC1=C(SC(=N1)C2=CC(=CC=C2)F)CCNC(=O)C3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C21H19FN2O3S/c1-13-18(28-20(24-13)14-6-5-7-15(22)12-14)10-11-23-19(25)16-8-3-4-9-17(16)21(26)27-2/h3-9,12H,10-11H2,1-2H3,(H,23,25)