N-[(1R)-1-(1H-benzimidazol-2-yl)-3-methyl-butyl]-2-methylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[(1R)-1-(1H-benzimidazol-2-yl)-3-methyl-butyl]-2-methylsulfanyl-pyridine-3-carboxamide Openeye Name: N-[(1R)-1-(1H-benzimidazol-2-yl)-3-methyl-butyl]-2-methylsulfanyl-pyridine-3-carboxamide CAS Name: N-[(1R)-1-(1H-benzimidazol-2-yl)-3-methylbutyl]-2-(methylthio)-3-pyridinecarboxamide IUPAC Name: N-[(1R)-1-(1H-benzimidazol-2-yl)-3-methylbutyl]-2-methylsulfanylpyridine-3-carboxamide Traditional Name: N-[(1R)-1-(1H-benzimidazol-2-yl)-3-methyl-butyl]-2-(methylthio)nicotinamide Formula: C19H22N4OS MolecularWeight: 354.46918

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=NC2=CC=CC=C2N1)NC(=O)C3=C(N=CC=C3)SC

Isomeric SMILES

CC(C)C[C@H](C1=NC2=CC=CC=C2N1)NC(=O)C3=C(N=CC=C3)SC

InChI

InChI=1S/C19H22N4OS/c1-12(2)11-16(17-21-14-8-4-5-9-15(14)22-17)23-18(24)13-7-6-10-20-19(13)25-3/h4-10,12,16H,11H2,1-3H3,(H,21,22)(H,23,24)/t16-/m1/s1