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

Systemtic Name: methyl 2-[[2-(4-fluorophenyl)-4-methyl-1,3-thiazol-5-yl]carbonylamino]-5-morpholin-4-yl-benzoate Openeye Name: methyl 2-[[2-(4-fluorophenyl)-4-methyl-thiazole-5-carbonyl]amino]-5-morpholino-benzoate CAS Name: 2-[[[2-(4-fluorophenyl)-4-methyl-5-thiazolyl]-oxomethyl]amino]-5-(4-morpholinyl)benzoic acid methyl ester IUPAC Name: methyl 2-[[2-(4-fluorophenyl)-4-methyl-1,3-thiazole-5-carbonyl]amino]-5-morpholin-4-ylbenzoate Traditional Name: 2-[[2-(4-fluorophenyl)-4-methyl-thiazole-5-carbonyl]amino]-5-morpholino-benzoic acid methyl ester Formula: C23H22FN3O4S MolecularWeight: 455.501883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC=C(C=C2)F)C(=O)NC3=C(C=C(C=C3)N4CCOCC4)C(=O)OC

Isomeric SMILES

CC1=C(SC(=N1)C2=CC=C(C=C2)F)C(=O)NC3=C(C=C(C=C3)N4CCOCC4)C(=O)OC

InChI

InChI=1S/C23H22FN3O4S/c1-14-20(32-22(25-14)15-3-5-16(24)6-4-15)21(28)26-19-8-7-17(13-18(19)23(29)30-2)27-9-11-31-12-10-27/h3-8,13H,9-12H2,1-2H3,(H,26,28)