methyl 5-(4-tert-butylphenyl)-3-[(4-chlorophenyl)sulfonylamino]thiophene-2-carboxylate

Systemtic Name: methyl 5-(4-tert-butylphenyl)-3-[(4-chlorophenyl)sulfonylamino]thiophene-2-carboxylate Openeye Name: methyl 5-(4-tert-butylphenyl)-3-[(4-chlorophenyl)sulfonylamino]thiophene-2-carboxylate CAS Name: 5-(4-tert-butylphenyl)-3-[(4-chlorophenyl)sulfonylamino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(4-tert-butylphenyl)-3-[(4-chlorophenyl)sulfonylamino]thiophene-2-carboxylate Traditional Name: 5-(4-tert-butylphenyl)-3-[(4-chlorophenyl)sulfonylamino]thiophene-2-carboxylic acid methyl ester Formula: C22H22ClNO4S2 MolecularWeight: 463.99738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=CC(=C(S2)C(=O)OC)NS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=CC(=C(S2)C(=O)OC)NS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H22ClNO4S2/c1-22(2,3)15-7-5-14(6-8-15)19-13-18(20(29-19)21(25)28-4)24-30(26,27)17-11-9-16(23)10-12-17/h5-13,24H,1-4H3