2-(1H-benzimidazol-2-ylsulfanylmethyl)-3-methyl-1H-pyridin-4-one

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanylmethyl)-3-methyl-1H-pyridin-4-one Openeye Name: 2-(1H-benzimidazol-2-ylsulfanylmethyl)-3-methyl-1H-pyridin-4-one CAS Name: 2-[(1H-benzimidazol-2-ylthio)methyl]-3-methyl-1H-pyridin-4-one IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanylmethyl)-3-methyl-1H-pyridin-4-one Traditional Name: 2-[(1H-benzimidazol-2-ylthio)methyl]-3-methyl-4-pyridone Formula: C14H13N3OS MolecularWeight: 271.33752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC=CC1=O)CSC2=NC3=CC=CC=C3N2

Isomeric SMILES

CC1=C(NC=CC1=O)CSC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C14H13N3OS/c1-9-12(15-7-6-13(9)18)8-19-14-16-10-4-2-3-5-11(10)17-14/h2-7H,8H2,1H3,(H,15,18)(H,16,17)