ethyl 4-cyano-5-[[4-[ethyl-(phenylmethyl)sulfamoyl]phenyl]carbonylamino]-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 4-cyano-5-[[4-[ethyl-(phenylmethyl)sulfamoyl]phenyl]carbonylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 5-[[4-[benzyl(ethyl)sulfamoyl]benzoyl]amino]-4-cyano-3-methyl-thiophene-2-carboxylate CAS Name: 4-cyano-5-[[[4-[ethyl-(phenylmethyl)sulfamoyl]phenyl]-oxomethyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[4-[benzyl(ethyl)sulfamoyl]benzoyl]amino]-4-cyano-3-methylthiophene-2-carboxylate Traditional Name: 5-[[4-[benzyl(ethyl)sulfamoyl]benzoyl]amino]-4-cyano-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C25H25N3O5S2 MolecularWeight: 511.6131

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=C(C(=C(S3)C(=O)OCC)C)C#N

Isomeric SMILES

CCN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=C(C(=C(S3)C(=O)OCC)C)C#N

InChI

InChI=1S/C25H25N3O5S2/c1-4-28(16-18-9-7-6-8-10-18)35(31,32)20-13-11-19(12-14-20)23(29)27-24-21(15-26)17(3)22(34-24)25(30)33-5-2/h6-14H,4-5,16H2,1-3H3,(H,27,29)