N-[[2-(dimethylamino)pyridin-3-yl]methyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[[2-(dimethylamino)pyridin-3-yl]methyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: N-[[2-(dimethylamino)-3-pyridyl]methyl]-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: N-[[2-(dimethylamino)-3-pyridinyl]methyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: N-[[2-(dimethylamino)pyridin-3-yl]methyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: N-[[2-(dimethylamino)-3-pyridyl]methyl]-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C17H21N3OS MolecularWeight: 315.43314

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=CC=N1)CNC(=O)C2=CC3=C(S2)CCCC3

Isomeric SMILES

CN(C)C1=C(C=CC=N1)CNC(=O)C2=CC3=C(S2)CCCC3

InChI

InChI=1S/C17H21N3OS/c1-20(2)16-13(7-5-9-18-16)11-19-17(21)15-10-12-6-3-4-8-14(12)22-15/h5,7,9-10H,3-4,6,8,11H2,1-2H3,(H,19,21)