ethyl 2-[5-methylsulfonyl-1-(phenylmethyl)benzimidazol-2-yl]sulfanylethanoate

Systemtic Name: ethyl 2-[5-methylsulfonyl-1-(phenylmethyl)benzimidazol-2-yl]sulfanylethanoate Openeye Name: ethyl 2-(1-benzyl-5-methylsulfonyl-benzimidazol-2-yl)sulfanylacetate CAS Name: 2-[[5-methylsulfonyl-1-(phenylmethyl)-2-benzimidazolyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-(1-benzyl-5-methylsulfonylbenzimidazol-2-yl)sulfanylacetate Traditional Name: 2-[(1-benzyl-5-mesyl-benzimidazol-2-yl)thio]acetic acid ethyl ester Formula: C19H20N2O4S2 MolecularWeight: 404.5031

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC2=C(N1CC3=CC=CC=C3)C=CC(=C2)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)CSC1=NC2=C(N1CC3=CC=CC=C3)C=CC(=C2)S(=O)(=O)C

InChI

InChI=1S/C19H20N2O4S2/c1-3-25-18(22)13-26-19-20-16-11-15(27(2,23)24)9-10-17(16)21(19)12-14-7-5-4-6-8-14/h4-11H,3,12-13H2,1-2H3