N-(1,3-benzodioxol-5-ylmethyl)-2-[1-(phenylmethyl)imidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[1-(phenylmethyl)imidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(1-benzylimidazol-2-yl)sulfanyl-acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[1-(phenylmethyl)-2-imidazolyl]thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(1-benzylimidazol-2-yl)sulfanylacetamide Traditional Name: 2-[(1-benzylimidazol-2-yl)thio]-N-piperonyl-acetamide Formula: C20H19N3O3S MolecularWeight: 381.44816

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)CSC3=NC=CN3CC4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)CSC3=NC=CN3CC4=CC=CC=C4

InChI

InChI=1S/C20H19N3O3S/c24-19(22-11-16-6-7-17-18(10-16)26-14-25-17)13-27-20-21-8-9-23(20)12-15-4-2-1-3-5-15/h1-10H,11-14H2,(H,22,24)