N-(1,3-benzodioxol-5-ylmethyl)-2-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(6-nitro-1H-benzimidazol-2-yl)thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]acetamide Traditional Name: 2-[(6-nitro-1H-benzimidazol-2-yl)thio]-N-piperonyl-acetamide Formula: C17H14N4O5S MolecularWeight: 386.38186

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)CSC3=NC4=C(N3)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)CSC3=NC4=C(N3)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H14N4O5S/c22-16(18-7-10-1-4-14-15(5-10)26-9-25-14)8-27-17-19-12-3-2-11(21(23)24)6-13(12)20-17/h1-6H,7-9H2,(H,18,22)(H,19,20)