(2-acetamido-1,3-thiazol-4-yl)methyl 3-(4-fluorophenyl)-2-methylsulfanyl-imidazole-4-carboxylate

Systemtic Name: (2-acetamido-1,3-thiazol-4-yl)methyl 3-(4-fluorophenyl)-2-methylsulfanyl-imidazole-4-carboxylate Openeye Name: (2-acetamidothiazol-4-yl)methyl 3-(4-fluorophenyl)-2-methylsulfanyl-imidazole-4-carboxylate CAS Name: 3-(4-fluorophenyl)-2-(methylthio)-4-imidazolecarboxylic acid (2-acetamido-4-thiazolyl)methyl ester IUPAC Name: (2-acetamido-1,3-thiazol-4-yl)methyl 3-(4-fluorophenyl)-2-methylsulfanylimidazole-4-carboxylate Traditional Name: 3-(4-fluorophenyl)-2-(methylthio)imidazole-4-carboxylic acid (2-acetamidothiazol-4-yl)methyl ester Formula: C17H15FN4O3S2 MolecularWeight: 406.454403

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=CS1)COC(=O)C2=CN=C(N2C3=CC=C(C=C3)F)SC

Isomeric SMILES

CC(=O)NC1=NC(=CS1)COC(=O)C2=CN=C(N2C3=CC=C(C=C3)F)SC

InChI

InChI=1S/C17H15FN4O3S2/c1-10(23)20-16-21-12(9-27-16)8-25-15(24)14-7-19-17(26-2)22(14)13-5-3-11(18)4-6-13/h3-7,9H,8H2,1-2H3,(H,20,21,23)