N-[[2-(dimethylamino)pyridin-4-yl]methyl]-2-(oxolan-2-ylmethylsulfanyl)benzamide

Systemtic Name: N-[[2-(dimethylamino)pyridin-4-yl]methyl]-2-(oxolan-2-ylmethylsulfanyl)benzamide Openeye Name: N-[[2-(dimethylamino)-4-pyridyl]methyl]-2-(tetrahydrofuran-2-ylmethylsulfanyl)benzamide CAS Name: N-[[2-(dimethylamino)-4-pyridinyl]methyl]-2-(2-oxolanylmethylthio)benzamide IUPAC Name: N-[[2-(dimethylamino)pyridin-4-yl]methyl]-2-(oxolan-2-ylmethylsulfanyl)benzamide Traditional Name: N-[[2-(dimethylamino)-4-pyridyl]methyl]-2-(tetrahydrofurfurylthio)benzamide Formula: C20H25N3O2S MolecularWeight: 371.4964

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC=CC(=C1)CNC(=O)C2=CC=CC=C2SCC3CCCO3

Isomeric SMILES

CN(C)C1=NC=CC(=C1)CNC(=O)C2=CC=CC=C2SCC3CCCO3

InChI

InChI=1S/C20H25N3O2S/c1-23(2)19-12-15(9-10-21-19)13-22-20(24)17-7-3-4-8-18(17)26-14-16-6-5-11-25-16/h3-4,7-10,12,16H,5-6,11,13-14H2,1-2H3,(H,22,24)