(6S)-6-methyl-2-(quinolin-8-ylsulfonylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: (6S)-6-methyl-2-(quinolin-8-ylsulfonylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: (6S)-6-methyl-2-(8-quinolylsulfonylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: (6S)-6-methyl-2-(8-quinolinylsulfonylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: (6S)-6-methyl-2-(quinolin-8-ylsulfonylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: (6S)-6-methyl-2-(8-quinolylsulfonylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C19H19N3O3S2 MolecularWeight: 401.50246

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C(=O)N)NS(=O)(=O)C3=CC=CC4=C3N=CC=C4

Isomeric SMILES

C[C@H]1CCC2=C(C1)SC(=C2C(=O)N)NS(=O)(=O)C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C19H19N3O3S2/c1-11-7-8-13-14(10-11)26-19(16(13)18(20)23)22-27(24,25)15-6-2-4-12-5-3-9-21-17(12)15/h2-6,9,11,22H,7-8,10H2,1H3,(H2,20,23)/t11-/m0/s1