N-[6-(dimethylamino)pyridin-3-yl]-2-(phenylmethylsulfanyl)propanamide

Systemtic Name: N-[6-(dimethylamino)pyridin-3-yl]-2-(phenylmethylsulfanyl)propanamide Openeye Name: 2-benzylsulfanyl-N-[6-(dimethylamino)-3-pyridyl]propanamide CAS Name: N-[6-(dimethylamino)-3-pyridinyl]-2-(phenylmethylthio)propanamide IUPAC Name: 2-benzylsulfanyl-N-[6-(dimethylamino)pyridin-3-yl]propanamide Traditional Name: 2-(benzylthio)-N-[6-(dimethylamino)-3-pyridyl]propionamide Formula: C17H21N3OS MolecularWeight: 315.43314

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CN=C(C=C1)N(C)C)SCC2=CC=CC=C2

Isomeric SMILES

CC(C(=O)NC1=CN=C(C=C1)N(C)C)SCC2=CC=CC=C2

InChI

InChI=1S/C17H21N3OS/c1-13(22-12-14-7-5-4-6-8-14)17(21)19-15-9-10-16(18-11-15)20(2)3/h4-11,13H,12H2,1-3H3,(H,19,21)