5-(4-fluoranyl-2-methyl-phenyl)-4-(4-methylsulfonylphenyl)-1,3-thiazole-2-carboxylate

Systemtic Name: 5-(4-fluoranyl-2-methyl-phenyl)-4-(4-methylsulfonylphenyl)-1,3-thiazole-2-carboxylate Openeye Name: 5-(4-fluoro-2-methyl-phenyl)-4-(4-methylsulfonylphenyl)thiazole-2-carboxylate CAS Name: 5-(4-fluoro-2-methylphenyl)-4-(4-methylsulfonylphenyl)-2-thiazolecarboxylate IUPAC Name: 5-(4-fluoro-2-methylphenyl)-4-(4-methylsulfonylphenyl)-1,3-thiazole-2-carboxylate Traditional Name: 5-(4-fluoro-2-methyl-phenyl)-4-(4-mesylphenyl)thiazole-2-carboxylate Formula: C18H13FNO4S2- MolecularWeight: 390.428523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)F)C2=C(N=C(S2)C(=O)[O-])C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)F)C2=C(N=C(S2)C(=O)[O-])C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C18H14FNO4S2/c1-10-9-12(19)5-8-14(10)16-15(20-17(25-16)18(21)22)11-3-6-13(7-4-11)26(2,23)24/h3-9H,1-2H3,(H,21,22)/p-1