N-[(2S)-2-(dimethylamino)-2-thiophen-2-yl-ethyl]-2-methylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[(2S)-2-(dimethylamino)-2-thiophen-2-yl-ethyl]-2-methylsulfanyl-pyridine-3-carboxamide Openeye Name: N-[(2S)-2-(dimethylamino)-2-(2-thienyl)ethyl]-2-methylsulfanyl-pyridine-3-carboxamide CAS Name: N-[(2S)-2-(dimethylamino)-2-thiophen-2-ylethyl]-2-(methylthio)-3-pyridinecarboxamide IUPAC Name: N-[(2S)-2-(dimethylamino)-2-thiophen-2-ylethyl]-2-methylsulfanylpyridine-3-carboxamide Traditional Name: N-[(2S)-2-(dimethylamino)-2-(2-thienyl)ethyl]-2-(methylthio)nicotinamide Formula: C15H19N3OS2 MolecularWeight: 321.46086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC(=O)C1=C(N=CC=C1)SC)C2=CC=CS2

Isomeric SMILES

CN(C)[C@@H](CNC(=O)C1=C(N=CC=C1)SC)C2=CC=CS2

InChI

InChI=1S/C15H19N3OS2/c1-18(2)12(13-7-5-9-21-13)10-17-14(19)11-6-4-8-16-15(11)20-3/h4-9,12H,10H2,1-3H3,(H,17,19)/t12-/m0/s1