N,N-bis(cyanomethyl)-3H-benzimidazole-5-carboxamide

Systemtic Name: N,N-bis(cyanomethyl)-3H-benzimidazole-5-carboxamide Openeye Name: N,N-bis(cyanomethyl)-3H-benzimidazole-5-carboxamide CAS Name: N,N-bis(cyanomethyl)-3H-benzimidazole-5-carboxamide IUPAC Name: N,N-bis(cyanomethyl)-3H-benzimidazole-5-carboxamide Traditional Name: N,N-bis(cyanomethyl)-3H-benzimidazole-5-carboxamide Formula: C12H9N5O MolecularWeight: 239.23276

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=O)N(CC#N)CC#N)NC=N2

Isomeric SMILES

C1=CC2=C(C=C1C(=O)N(CC#N)CC#N)NC=N2

InChI

InChI=1S/C12H9N5O/c13-3-5-17(6-4-14)12(18)9-1-2-10-11(7-9)16-8-15-10/h1-2,7-8H,5-6H2,(H,15,16)