propyl (6R)-6-methyl-2-(phenylsulfonylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: propyl (6R)-6-methyl-2-(phenylsulfonylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: propyl (6R)-2-(benzenesulfonamido)-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: (6R)-2-(benzenesulfonamido)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid propyl ester IUPAC Name: propyl (6R)-2-(benzenesulfonamido)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: (6R)-2-(benzenesulfonamido)-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid propyl ester Formula: C19H23NO4S2 MolecularWeight: 393.52022

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(SC2=C1CCC(C2)C)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCCOC(=O)C1=C(SC2=C1CC[C@H](C2)C)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H23NO4S2/c1-3-11-24-19(21)17-15-10-9-13(2)12-16(15)25-18(17)20-26(22,23)14-7-5-4-6-8-14/h4-8,13,20H,3,9-12H2,1-2H3/t13-/m1/s1