ethyl 2-[(4-ethylsulfanyl-3-methyl-pyridin-2-yl)methylsulfinyl]benzimidazole-1-carboxylate

Systemtic Name: ethyl 2-[(4-ethylsulfanyl-3-methyl-pyridin-2-yl)methylsulfinyl]benzimidazole-1-carboxylate Openeye Name: ethyl 2-[(4-ethylsulfanyl-3-methyl-2-pyridyl)methylsulfinyl]benzimidazole-1-carboxylate CAS Name: 2-[[4-(ethylthio)-3-methyl-2-pyridinyl]methylsulfinyl]-1-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-ethylsulfanyl-3-methylpyridin-2-yl)methylsulfinyl]benzimidazole-1-carboxylate Traditional Name: 2-[[4-(ethylthio)-3-methyl-2-pyridyl]methylsulfinyl]benzimidazole-1-carboxylic acid ethyl ester Formula: C19H21N3O3S2 MolecularWeight: 403.51834

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C2=CC=CC=C2N=C1S(=O)CC3=NC=CC(=C3C)SCC

Isomeric SMILES

CCOC(=O)N1C2=CC=CC=C2N=C1S(=O)CC3=NC=CC(=C3C)SCC

InChI

InChI=1S/C19H21N3O3S2/c1-4-25-19(23)22-16-9-7-6-8-14(16)21-18(22)27(24)12-15-13(3)17(26-5-2)10-11-20-15/h6-11H,4-5,12H2,1-3H3