methyl 2-[(3,4-dimethoxypyridin-2-yl)methylsulfanyl]-6-methyl-1H-benzimidazole-5-carboxylate

Systemtic Name: methyl 2-[(3,4-dimethoxypyridin-2-yl)methylsulfanyl]-6-methyl-1H-benzimidazole-5-carboxylate Openeye Name: methyl 2-[(3,4-dimethoxy-2-pyridyl)methylsulfanyl]-6-methyl-1H-benzimidazole-5-carboxylate CAS Name: 2-[(3,4-dimethoxy-2-pyridinyl)methylthio]-6-methyl-1H-benzimidazole-5-carboxylic acid methyl ester IUPAC Name: methyl 2-[(3,4-dimethoxypyridin-2-yl)methylsulfanyl]-6-methyl-1H-benzimidazole-5-carboxylate Traditional Name: 2-[(3,4-dimethoxy-2-pyridyl)methylthio]-6-methyl-1H-benzimidazole-5-carboxylic acid methyl ester Formula: C18H19N3O4S MolecularWeight: 373.42616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C(=O)OC)N=C(N2)SCC3=NC=CC(=C3OC)OC

Isomeric SMILES

CC1=CC2=C(C=C1C(=O)OC)N=C(N2)SCC3=NC=CC(=C3OC)OC

InChI

InChI=1S/C18H19N3O4S/c1-10-7-12-13(8-11(10)17(22)25-4)21-18(20-12)26-9-14-16(24-3)15(23-2)5-6-19-14/h5-8H,9H2,1-4H3,(H,20,21)