methyl 2-[(4-acetamidophenyl)sulfonylamino]-4-methyl-5-(phenylmethyl)thiophene-3-carboxylate

Systemtic Name: methyl 2-[(4-acetamidophenyl)sulfonylamino]-4-methyl-5-(phenylmethyl)thiophene-3-carboxylate Openeye Name: methyl 2-[(4-acetamidophenyl)sulfonylamino]-5-benzyl-4-methyl-thiophene-3-carboxylate CAS Name: 2-[(4-acetamidophenyl)sulfonylamino]-4-methyl-5-(phenylmethyl)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(4-acetamidophenyl)sulfonylamino]-5-benzyl-4-methylthiophene-3-carboxylate Traditional Name: 2-[(4-acetamidophenyl)sulfonylamino]-5-benzyl-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C22H22N2O5S2 MolecularWeight: 458.55048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C)CC3=CC=CC=C3

InChI

InChI=1S/C22H22N2O5S2/c1-14-19(13-16-7-5-4-6-8-16)30-21(20(14)22(26)29-3)24-31(27,28)18-11-9-17(10-12-18)23-15(2)25/h4-12,24H,13H2,1-3H3,(H,23,25)