[2-[(4-ethylsulfanyl-3-methyl-pyridin-2-yl)methylsulfinyl]benzimidazol-1-yl]methyl 2,2-dimethylpropanoate

Systemtic Name: [2-[(4-ethylsulfanyl-3-methyl-pyridin-2-yl)methylsulfinyl]benzimidazol-1-yl]methyl 2,2-dimethylpropanoate Openeye Name: [2-[(4-ethylsulfanyl-3-methyl-2-pyridyl)methylsulfinyl]benzimidazol-1-yl]methyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [2-[[4-(ethylthio)-3-methyl-2-pyridinyl]methylsulfinyl]-1-benzimidazolyl]methyl ester IUPAC Name: [2-[(4-ethylsulfanyl-3-methylpyridin-2-yl)methylsulfinyl]benzimidazol-1-yl]methyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [2-[[4-(ethylthio)-3-methyl-2-pyridyl]methylsulfinyl]benzimidazol-1-yl]methyl ester Formula: C22H27N3O3S2 MolecularWeight: 445.59808

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C(=NC=C1)CS(=O)C2=NC3=CC=CC=C3N2COC(=O)C(C)(C)C)C

Isomeric SMILES

CCSC1=C(C(=NC=C1)CS(=O)C2=NC3=CC=CC=C3N2COC(=O)C(C)(C)C)C

InChI

InChI=1S/C22H27N3O3S2/c1-6-29-19-11-12-23-17(15(19)2)13-30(27)21-24-16-9-7-8-10-18(16)25(21)14-28-20(26)22(3,4)5/h7-12H,6,13-14H2,1-5H3