N-[(2-piperidin-1-ylsulfonylphenyl)methyl]-1-benzothiophene-3-carboxamide

Systemtic Name: N-[(2-piperidin-1-ylsulfonylphenyl)methyl]-1-benzothiophene-3-carboxamide Openeye Name: N-[[2-(1-piperidylsulfonyl)phenyl]methyl]benzothiophene-3-carboxamide CAS Name: N-[[2-(1-piperidinylsulfonyl)phenyl]methyl]-1-benzothiophene-3-carboxamide IUPAC Name: N-[(2-piperidin-1-ylsulfonylphenyl)methyl]-1-benzothiophene-3-carboxamide Traditional Name: N-(2-piperidinosulfonylbenzyl)benzothiophene-3-carboxamide Formula: C21H22N2O3S2 MolecularWeight: 414.54098

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2CNC(=O)C3=CSC4=CC=CC=C43

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2CNC(=O)C3=CSC4=CC=CC=C43

InChI

InChI=1S/C21H22N2O3S2/c24-21(18-15-27-19-10-4-3-9-17(18)19)22-14-16-8-2-5-11-20(16)28(25,26)23-12-6-1-7-13-23/h2-5,8-11,15H,1,6-7,12-14H2,(H,22,24)