N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-6-oxidanylidene-1H-pyridine-3-carboxamide

Systemtic Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-6-oxidanylidene-1H-pyridine-3-carboxamide Openeye Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-6-oxo-1H-pyridine-3-carboxamide CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-6-oxo-1H-pyridine-3-carboxamide IUPAC Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-6-oxo-1H-pyridine-3-carboxamide Traditional Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-6-keto-1H-pyridine-3-carboxamide Formula: C17H18N4O2S MolecularWeight: 342.41542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)C3=CNC(=O)C=C3

Isomeric SMILES

CSCC[C@@H](C1=NC2=CC=CC=C2N1)NC(=O)C3=CNC(=O)C=C3

InChI

InChI=1S/C17H18N4O2S/c1-24-9-8-14(16-19-12-4-2-3-5-13(12)20-16)21-17(23)11-6-7-15(22)18-10-11/h2-7,10,14H,8-9H2,1H3,(H,18,22)(H,19,20)(H,21,23)/t14-/m0/s1