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

Systemtic Name: propan-2-yl 2-[(4-ethylsulfanyl-3-methyl-pyridin-2-yl)methylsulfinyl]benzimidazole-1-carboxylate Openeye Name: isopropyl 2-[(4-ethylsulfanyl-3-methyl-2-pyridyl)methylsulfinyl]benzimidazole-1-carboxylate CAS Name: 2-[[4-(ethylthio)-3-methyl-2-pyridinyl]methylsulfinyl]-1-benzimidazolecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 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 isopropyl ester Formula: C20H23N3O3S2 MolecularWeight: 417.54492

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C(=NC=C1)CS(=O)C2=NC3=CC=CC=C3N2C(=O)OC(C)C)C

Isomeric SMILES

CCSC1=C(C(=NC=C1)CS(=O)C2=NC3=CC=CC=C3N2C(=O)OC(C)C)C

InChI

InChI=1S/C20H23N3O3S2/c1-5-27-18-10-11-21-16(14(18)4)12-28(25)19-22-15-8-6-7-9-17(15)23(19)20(24)26-13(2)3/h6-11,13H,5,12H2,1-4H3