N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N-[(2-morpholinosulfonylphenyl)methyl]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: N-[[2-(4-morpholinylsulfonyl)phenyl]methyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-(2-morpholinosulfonylbenzyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C20H24N2O4S2 MolecularWeight: 420.54556

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=CS2)C(=O)NCC3=CC=CC=C3S(=O)(=O)N4CCOCC4

Isomeric SMILES

C1CCC2=C(C1)C(=CS2)C(=O)NCC3=CC=CC=C3S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C20H24N2O4S2/c23-20(17-14-27-18-7-3-2-6-16(17)18)21-13-15-5-1-4-8-19(15)28(24,25)22-9-11-26-12-10-22/h1,4-5,8,14H,2-3,6-7,9-13H2,(H,21,23)