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

Systemtic Name: [4-[(5-chloranyl-3-methyl-1-benzothiophen-2-yl)sulfonylamino]-3-methylsulfonyl-phenyl] 1,3-oxazole-4-carboxylate Openeye Name: [4-[(5-chloro-3-methyl-benzothiophen-2-yl)sulfonylamino]-3-methylsulfonyl-phenyl] oxazole-4-carboxylate CAS Name: 4-oxazolecarboxylic acid [4-[(5-chloro-3-methyl-1-benzothiophen-2-yl)sulfonylamino]-3-methylsulfonylphenyl] ester IUPAC Name: [4-[(5-chloro-3-methyl-1-benzothiophen-2-yl)sulfonylamino]-3-methylsulfonylphenyl] 1,3-oxazole-4-carboxylate Traditional Name: oxazole-4-carboxylic acid [4-[(5-chloro-3-methyl-benzothiophen-2-yl)sulfonylamino]-3-mesyl-phenyl] ester Formula: C20H15ClN2O7S3 MolecularWeight: 526.9903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C=C(C=C2)Cl)S(=O)(=O)NC3=C(C=C(C=C3)OC(=O)C4=COC=N4)S(=O)(=O)C

Isomeric SMILES

CC1=C(SC2=C1C=C(C=C2)Cl)S(=O)(=O)NC3=C(C=C(C=C3)OC(=O)C4=COC=N4)S(=O)(=O)C

InChI

InChI=1S/C20H15ClN2O7S3/c1-11-14-7-12(21)3-6-17(14)31-20(11)33(27,28)23-15-5-4-13(8-18(15)32(2,25)26)30-19(24)16-9-29-10-22-16/h3-10,23H,1-2H3