N-[(2-methoxypyridin-4-yl)methyl]-4-phenylsulfanyl-butanamide

Systemtic Name: N-[(2-methoxypyridin-4-yl)methyl]-4-phenylsulfanyl-butanamide Openeye Name: N-[(2-methoxy-4-pyridyl)methyl]-4-phenylsulfanyl-butanamide CAS Name: N-[(2-methoxy-4-pyridinyl)methyl]-4-(phenylthio)butanamide IUPAC Name: N-[(2-methoxypyridin-4-yl)methyl]-4-phenylsulfanylbutanamide Traditional Name: N-[(2-methoxy-4-pyridyl)methyl]-4-(phenylthio)butyramide Formula: C17H20N2O2S MolecularWeight: 316.4179

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=CC(=C1)CNC(=O)CCCSC2=CC=CC=C2

Isomeric SMILES

COC1=NC=CC(=C1)CNC(=O)CCCSC2=CC=CC=C2

InChI

InChI=1S/C17H20N2O2S/c1-21-17-12-14(9-10-18-17)13-19-16(20)8-5-11-22-15-6-3-2-4-7-15/h2-4,6-7,9-10,12H,5,8,11,13H2,1H3,(H,19,20)