(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]ethanoate

Systemtic Name: (6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]ethanoate Openeye Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]acetate CAS Name: 2-[2-[(methylthio)methyl]-1-benzimidazolyl]acetic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]acetate Traditional Name: 2-[2-[(methylthio)methyl]benzimidazol-1-yl]acetic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C20H19ClN2O4S MolecularWeight: 418.89386

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Descriptors Computed from Structure

Canonical SMILES:

CSCC1=NC2=CC=CC=C2N1CC(=O)OCC3=C4C(=CC(=C3)Cl)COCO4

Isomeric SMILES

CSCC1=NC2=CC=CC=C2N1CC(=O)OCC3=C4C(=CC(=C3)Cl)COCO4

InChI

InChI=1S/C20H19ClN2O4S/c1-28-11-18-22-16-4-2-3-5-17(16)23(18)8-19(24)26-10-14-7-15(21)6-13-9-25-12-27-20(13)14/h2-7H,8-12H2,1H3