O2-(cyanomethyl) O4-methyl 3-methyl-5-[(phenylmethyl)sulfamoyl]thiophene-2,4-dicarboxylate

Systemtic Name: O2-(cyanomethyl) O4-methyl 3-methyl-5-[(phenylmethyl)sulfamoyl]thiophene-2,4-dicarboxylate Openeye Name: O2-(cyanomethyl) O4-methyl 5-(benzylsulfamoyl)-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[(phenylmethyl)sulfamoyl]thiophene-2,4-dicarboxylic acid O2-(cyanomethyl) ester O4-methyl ester IUPAC Name: 2-O-(cyanomethyl) 4-O-methyl 5-(benzylsulfamoyl)-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-(benzylsulfamoyl)-3-methyl-thiophene-2,4-dicarboxylic acid O2-(cyanomethyl) ester O4-methyl ester Formula: C17H16N2O6S2 MolecularWeight: 408.44874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)S(=O)(=O)NCC2=CC=CC=C2)C(=O)OCC#N

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)S(=O)(=O)NCC2=CC=CC=C2)C(=O)OCC#N

InChI

InChI=1S/C17H16N2O6S2/c1-11-13(15(20)24-2)17(26-14(11)16(21)25-9-8-18)27(22,23)19-10-12-6-4-3-5-7-12/h3-7,19H,9-10H2,1-2H3