N4-[2-(2-azanylethyl)phenyl]-N5-(1H-benzimidazol-2-yl)-1H-imidazole-4,5-dicarboxamide

Systemtic Name: N4-[2-(2-azanylethyl)phenyl]-N5-(1H-benzimidazol-2-yl)-1H-imidazole-4,5-dicarboxamide Openeye Name: N4-[2-(2-aminoethyl)phenyl]-N5-(1H-benzimidazol-2-yl)-1H-imidazole-4,5-dicarboxamide CAS Name: N4-[2-(2-aminoethyl)phenyl]-N5-(1H-benzimidazol-2-yl)-1H-imidazole-4,5-dicarboxamide IUPAC Name: 4-N-[2-(2-aminoethyl)phenyl]-5-N-(1H-benzimidazol-2-yl)-1H-imidazole-4,5-dicarboxamide Traditional Name: N-[2-(2-aminoethyl)phenyl]-N'-(1H-benzimidazol-2-yl)-1H-imidazole-4,5-dicarboxamide Formula: C20H19N7O2 MolecularWeight: 389.41056

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CCN)NC(=O)C2=C(NC=N2)C(=O)NC3=NC4=CC=CC=C4N3

Isomeric SMILES

C1=CC=C(C(=C1)CCN)NC(=O)C2=C(NC=N2)C(=O)NC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C20H19N7O2/c21-10-9-12-5-1-2-6-13(12)24-18(28)16-17(23-11-22-16)19(29)27-20-25-14-7-3-4-8-15(14)26-20/h1-8,11H,9-10,21H2,(H,22,23)(H,24,28)(H2,25,26,27,29)