ethyl 2-[(2-chlorophenyl)methylsulfonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[(2-chlorophenyl)methylsulfonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[(2-chlorophenyl)methylsulfonylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[(2-chlorophenyl)methylsulfonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-chlorophenyl)methylsulfonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[(2-chlorobenzyl)sulfonylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C18H20ClNO4S2 MolecularWeight: 413.9387

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCCC2)NS(=O)(=O)CC3=CC=CC=C3Cl

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCCC2)NS(=O)(=O)CC3=CC=CC=C3Cl

InChI

InChI=1S/C18H20ClNO4S2/c1-2-24-18(21)16-13-8-4-6-10-15(13)25-17(16)20-26(22,23)11-12-7-3-5-9-14(12)19/h3,5,7,9,20H,2,4,6,8,10-11H2,1H3