tert-butyl 5-(1-benzothiophen-2-yl)-3-[(2-methylphenyl)sulfonylamino]thiophene-2-carboxylate

Systemtic Name: tert-butyl 5-(1-benzothiophen-2-yl)-3-[(2-methylphenyl)sulfonylamino]thiophene-2-carboxylate Openeye Name: tert-butyl 5-(benzothiophen-2-yl)-3-(o-tolylsulfonylamino)thiophene-2-carboxylate CAS Name: 5-(1-benzothiophen-2-yl)-3-[(2-methylphenyl)sulfonylamino]-2-thiophenecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-(1-benzothiophen-2-yl)-3-[(2-methylphenyl)sulfonylamino]thiophene-2-carboxylate Traditional Name: 5-(benzothiophen-2-yl)-3-(o-tolylsulfonylamino)thiophene-2-carboxylic acid tert-butyl ester Formula: C24H23NO4S3 MolecularWeight: 485.63872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1S(=O)(=O)NC2=C(SC(=C2)C3=CC4=CC=CC=C4S3)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=CC=C1S(=O)(=O)NC2=C(SC(=C2)C3=CC4=CC=CC=C4S3)C(=O)OC(C)(C)C

InChI

InChI=1S/C24H23NO4S3/c1-15-9-5-8-12-21(15)32(27,28)25-17-14-20(31-22(17)23(26)29-24(2,3)4)19-13-16-10-6-7-11-18(16)30-19/h5-14,25H,1-4H3