1,3-benzodioxol-5-yl 2-(1H-benzimidazol-2-ylmethylsulfanyl)ethanoate

Systemtic Name: 1,3-benzodioxol-5-yl 2-(1H-benzimidazol-2-ylmethylsulfanyl)ethanoate Openeye Name: 1,3-benzodioxol-5-yl 2-(1H-benzimidazol-2-ylmethylsulfanyl)acetate CAS Name: 2-(1H-benzimidazol-2-ylmethylthio)acetic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl 2-(1H-benzimidazol-2-ylmethylsulfanyl)acetate Traditional Name: 2-(1H-benzimidazol-2-ylmethylthio)acetic acid 1,3-benzodioxol-5-yl ester Formula: C17H14N2O4S MolecularWeight: 342.36906

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)OC(=O)CSCC3=NC4=CC=CC=C4N3

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)OC(=O)CSCC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C17H14N2O4S/c20-17(23-11-5-6-14-15(7-11)22-10-21-14)9-24-8-16-18-12-3-1-2-4-13(12)19-16/h1-7H,8-10H2,(H,18,19)