ethyl 5-[(4-tert-butylphenyl)sulfonylamino]-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 5-[(4-tert-butylphenyl)sulfonylamino]-1-benzothiophene-2-carboxylate Openeye Name: ethyl 5-[(4-tert-butylphenyl)sulfonylamino]benzothiophene-2-carboxylate CAS Name: 5-[(4-tert-butylphenyl)sulfonylamino]-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[(4-tert-butylphenyl)sulfonylamino]-1-benzothiophene-2-carboxylate Traditional Name: 5-[(4-tert-butylphenyl)sulfonylamino]benzothiophene-2-carboxylic acid ethyl ester Formula: C21H23NO4S2 MolecularWeight: 417.54162

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(S1)C=CC(=C2)NS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=CC2=C(S1)C=CC(=C2)NS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C21H23NO4S2/c1-5-26-20(23)19-13-14-12-16(8-11-18(14)27-19)22-28(24,25)17-9-6-15(7-10-17)21(2,3)4/h6-13,22H,5H2,1-4H3