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

Systemtic Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]pyridine-3-carboxamide Openeye Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]pyridine-3-carboxamide CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-3-pyridinecarboxamide IUPAC Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]pyridine-3-carboxamide Traditional Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]nicotinamide Formula: C17H18N4OS MolecularWeight: 326.41602

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N4OS/c1-23-10-8-15(21-17(22)12-5-4-9-18-11-12)16-19-13-6-2-3-7-14(13)20-16/h2-7,9,11,15H,8,10H2,1H3,(H,19,20)(H,21,22)/t15-/m0/s1