ethyl 4-cyano-5-[3-[4-(diethylsulfamoyl)phenyl]prop-2-enoylamino]-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 4-cyano-5-[3-[4-(diethylsulfamoyl)phenyl]prop-2-enoylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 4-cyano-5-[3-[4-(diethylsulfamoyl)phenyl]prop-2-enoylamino]-3-methyl-thiophene-2-carboxylate CAS Name: 4-cyano-5-[[3-[4-(diethylsulfamoyl)phenyl]-1-oxoprop-2-enyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyano-5-[3-[4-(diethylsulfamoyl)phenyl]prop-2-enoylamino]-3-methylthiophene-2-carboxylate Traditional Name: 4-cyano-5-[[3-[4-(diethylsulfamoyl)phenyl]acryloyl]amino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C22H25N3O5S2 MolecularWeight: 475.581

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C=CC(=O)NC2=C(C(=C(S2)C(=O)OCC)C)C#N

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C=CC(=O)NC2=C(C(=C(S2)C(=O)OCC)C)C#N

InChI

InChI=1S/C22H25N3O5S2/c1-5-25(6-2)32(28,29)17-11-8-16(9-12-17)10-13-19(26)24-21-18(14-23)15(4)20(31-21)22(27)30-7-3/h8-13H,5-7H2,1-4H3,(H,24,26)