2-[4-[(5-fluoranyl-3-methyl-1-benzothiophen-2-yl)sulfonylamino]-3-methylsulfonyl-phenyl]-4,5-dihydro-1,3-oxazole-4-carboxylate

Systemtic Name: 2-[4-[(5-fluoranyl-3-methyl-1-benzothiophen-2-yl)sulfonylamino]-3-methylsulfonyl-phenyl]-4,5-dihydro-1,3-oxazole-4-carboxylate Openeye Name: 2-[4-[(5-fluoro-3-methyl-benzothiophen-2-yl)sulfonylamino]-3-methylsulfonyl-phenyl]-4,5-dihydrooxazole-4-carboxylate CAS Name: 2-[4-[(5-fluoro-3-methyl-1-benzothiophen-2-yl)sulfonylamino]-3-methylsulfonylphenyl]-4,5-dihydrooxazole-4-carboxylate IUPAC Name: 2-[4-[(5-fluoro-3-methyl-1-benzothiophen-2-yl)sulfonylamino]-3-methylsulfonylphenyl]-4,5-dihydro-1,3-oxazole-4-carboxylate Traditional Name: 2-[4-[(5-fluoro-3-methyl-benzothiophen-2-yl)sulfonylamino]-3-mesyl-phenyl]-2-oxazoline-4-carboxylate Formula: C20H16FN2O7S3- MolecularWeight: 511.543643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C=C(C=C2)F)S(=O)(=O)NC3=C(C=C(C=C3)C4=NC(CO4)C(=O)[O-])S(=O)(=O)C

Isomeric SMILES

CC1=C(SC2=C1C=C(C=C2)F)S(=O)(=O)NC3=C(C=C(C=C3)C4=NC(CO4)C(=O)[O-])S(=O)(=O)C

InChI

InChI=1S/C20H17FN2O7S3/c1-10-13-8-12(21)4-6-16(13)31-20(10)33(28,29)23-14-5-3-11(7-17(14)32(2,26)27)18-22-15(9-30-18)19(24)25/h3-8,15,23H,9H2,1-2H3,(H,24,25)/p-1