N-[(1R)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]pyrazine-2-carboxamide

Systemtic Name: N-[(1R)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]pyrazine-2-carboxamide Openeye Name: N-[(1R)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]pyrazine-2-carboxamide CAS Name: N-[(1R)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-2-pyrazinecarboxamide IUPAC Name: N-[(1R)-1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]pyrazine-2-carboxamide Traditional Name: N-[(1R)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]pyrazinamide Formula: C16H17N5OS MolecularWeight: 327.40408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)C3=NC=CN=C3

Isomeric SMILES

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

InChI

InChI=1S/C16H17N5OS/c1-23-9-6-13(21-16(22)14-10-17-7-8-18-14)15-19-11-4-2-3-5-12(11)20-15/h2-5,7-8,10,13H,6,9H2,1H3,(H,19,20)(H,21,22)/t13-/m1/s1