methyl 3-[[4-(3-chloranyl-2-cyano-phenoxy)phenyl]sulfonylamino]-4-methylsulfonyl-thiophene-2-carboxylate

Systemtic Name: methyl 3-[[4-(3-chloranyl-2-cyano-phenoxy)phenyl]sulfonylamino]-4-methylsulfonyl-thiophene-2-carboxylate Openeye Name: methyl 3-[[4-(3-chloro-2-cyano-phenoxy)phenyl]sulfonylamino]-4-methylsulfonyl-thiophene-2-carboxylate CAS Name: 3-[[4-(3-chloro-2-cyanophenoxy)phenyl]sulfonylamino]-4-methylsulfonyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[4-(3-chloro-2-cyanophenoxy)phenyl]sulfonylamino]-4-methylsulfonylthiophene-2-carboxylate Traditional Name: 3-[[4-(3-chloro-2-cyano-phenoxy)phenyl]sulfonylamino]-4-mesyl-thiophene-2-carboxylic acid methyl ester Formula: C20H15ClN2O7S3 MolecularWeight: 526.9903

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=CS1)S(=O)(=O)C)NS(=O)(=O)C2=CC=C(C=C2)OC3=C(C(=CC=C3)Cl)C#N

Isomeric SMILES

COC(=O)C1=C(C(=CS1)S(=O)(=O)C)NS(=O)(=O)C2=CC=C(C=C2)OC3=C(C(=CC=C3)Cl)C#N

InChI

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