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

Systemtic Name: 2-[1-(1,3-benzodioxol-5-ylmethyl)imidazol-2-yl]sulfanyl-N-(1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-[1-(1,3-benzodioxol-5-ylmethyl)imidazol-2-yl]sulfanyl-N-(1,3-benzothiazol-2-yl)acetamide CAS Name: 2-[[1-(1,3-benzodioxol-5-ylmethyl)-2-imidazolyl]thio]-N-(1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-[1-(1,3-benzodioxol-5-ylmethyl)imidazol-2-yl]sulfanyl-N-(1,3-benzothiazol-2-yl)acetamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-[(1-piperonylimidazol-2-yl)thio]acetamide Formula: C20H16N4O3S2 MolecularWeight: 424.49604

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CN3C=CN=C3SCC(=O)NC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CN3C=CN=C3SCC(=O)NC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C20H16N4O3S2/c25-18(23-19-22-14-3-1-2-4-17(14)29-19)11-28-20-21-7-8-24(20)10-13-5-6-15-16(9-13)27-12-26-15/h1-9H,10-12H2,(H,22,23,25)