2-[1-(1,3-benzodioxol-5-ylmethyl)imidazol-2-yl]sulfanylethanamide

Systemtic Name: 2-[1-(1,3-benzodioxol-5-ylmethyl)imidazol-2-yl]sulfanylethanamide Openeye Name: 2-[1-(1,3-benzodioxol-5-ylmethyl)imidazol-2-yl]sulfanylacetamide CAS Name: 2-[[1-(1,3-benzodioxol-5-ylmethyl)-2-imidazolyl]thio]acetamide IUPAC Name: 2-[1-(1,3-benzodioxol-5-ylmethyl)imidazol-2-yl]sulfanylacetamide Traditional Name: 2-[(1-piperonylimidazol-2-yl)thio]acetamide Formula: C13H13N3O3S MolecularWeight: 291.32562

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CN3C=CN=C3SCC(=O)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CN3C=CN=C3SCC(=O)N

InChI

InChI=1S/C13H13N3O3S/c14-12(17)7-20-13-15-3-4-16(13)6-9-1-2-10-11(5-9)19-8-18-10/h1-5H,6-8H2,(H2,14,17)