[(3R)-2-oxidanylideneoxolan-3-yl] 2-[5-chloranyl-1-(phenylmethyl)benzimidazol-2-yl]sulfanylethanoate

Systemtic Name: [(3R)-2-oxidanylideneoxolan-3-yl] 2-[5-chloranyl-1-(phenylmethyl)benzimidazol-2-yl]sulfanylethanoate Openeye Name: [(3R)-2-oxotetrahydrofuran-3-yl] 2-(1-benzyl-5-chloro-benzimidazol-2-yl)sulfanylacetate CAS Name: 2-[[5-chloro-1-(phenylmethyl)-2-benzimidazolyl]thio]acetic acid [(3R)-2-oxo-3-oxolanyl] ester IUPAC Name: [(3R)-2-oxooxolan-3-yl] 2-(1-benzyl-5-chlorobenzimidazol-2-yl)sulfanylacetate Traditional Name: 2-[(1-benzyl-5-chloro-benzimidazol-2-yl)thio]acetic acid [(3R)-2-ketotetrahydrofuran-3-yl] ester Formula: C20H17ClN2O4S MolecularWeight: 416.87798

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(=O)C1OC(=O)CSC2=NC3=C(N2CC4=CC=CC=C4)C=CC(=C3)Cl

Isomeric SMILES

C1COC(=O)[C@@H]1OC(=O)CSC2=NC3=C(N2CC4=CC=CC=C4)C=CC(=C3)Cl

InChI

InChI=1S/C20H17ClN2O4S/c21-14-6-7-16-15(10-14)22-20(23(16)11-13-4-2-1-3-5-13)28-12-18(24)27-17-8-9-26-19(17)25/h1-7,10,17H,8-9,11-12H2/t17-/m1/s1