N-[(4-morpholin-4-ylsulfonylphenyl)methyl]-2,3-dihydro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[(4-morpholin-4-ylsulfonylphenyl)methyl]-2,3-dihydro-1-benzothiophene-2-carboxamide Openeye Name: N-[(4-morpholinosulfonylphenyl)methyl]-2,3-dihydrobenzothiophene-2-carboxamide CAS Name: N-[[4-(4-morpholinylsulfonyl)phenyl]methyl]-2,3-dihydro-1-benzothiophene-2-carboxamide IUPAC Name: N-[(4-morpholin-4-ylsulfonylphenyl)methyl]-2,3-dihydro-1-benzothiophene-2-carboxamide Traditional Name: N-(4-morpholinosulfonylbenzyl)-2,3-dihydrobenzothiophene-2-carboxamide Formula: C20H22N2O4S2 MolecularWeight: 418.52968

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)CNC(=O)C3CC4=CC=CC=C4S3

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)CNC(=O)C3CC4=CC=CC=C4S3

InChI

InChI=1S/C20H22N2O4S2/c23-20(19-13-16-3-1-2-4-18(16)27-19)21-14-15-5-7-17(8-6-15)28(24,25)22-9-11-26-12-10-22/h1-8,19H,9-14H2,(H,21,23)