methyl 4-methyl-5-(pentan-3-ylcarbamoyl)-2-[(phenylmethyl)sulfamoyl]thiophene-3-carboxylate

Systemtic Name: methyl 4-methyl-5-(pentan-3-ylcarbamoyl)-2-[(phenylmethyl)sulfamoyl]thiophene-3-carboxylate Openeye Name: methyl 2-(benzylsulfamoyl)-5-(1-ethylpropylcarbamoyl)-4-methyl-thiophene-3-carboxylate CAS Name: 4-methyl-5-[oxo-(pentan-3-ylamino)methyl]-2-[(phenylmethyl)sulfamoyl]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-(benzylsulfamoyl)-4-methyl-5-(pentan-3-ylcarbamoyl)thiophene-3-carboxylate Traditional Name: 2-(benzylsulfamoyl)-5-(1-ethylpropylcarbamoyl)-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C20H26N2O5S2 MolecularWeight: 438.56084

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)C1=C(C(=C(S1)S(=O)(=O)NCC2=CC=CC=C2)C(=O)OC)C

Isomeric SMILES

CCC(CC)NC(=O)C1=C(C(=C(S1)S(=O)(=O)NCC2=CC=CC=C2)C(=O)OC)C

InChI

InChI=1S/C20H26N2O5S2/c1-5-15(6-2)22-18(23)17-13(3)16(19(24)27-4)20(28-17)29(25,26)21-12-14-10-8-7-9-11-14/h7-11,15,21H,5-6,12H2,1-4H3,(H,22,23)