N-[4-(1H-benzimidazol-2-ylcarbamoyl)-1H-benzimidazol-2-yl]isoquinoline-3-carboxamide

Systemtic Name: N-[4-(1H-benzimidazol-2-ylcarbamoyl)-1H-benzimidazol-2-yl]isoquinoline-3-carboxamide Openeye Name: N-[4-(1H-benzimidazol-2-ylcarbamoyl)-1H-benzimidazol-2-yl]isoquinoline-3-carboxamide CAS Name: N-[4-[(1H-benzimidazol-2-ylamino)-oxomethyl]-1H-benzimidazol-2-yl]-3-isoquinolinecarboxamide IUPAC Name: N-[4-(1H-benzimidazol-2-ylcarbamoyl)-1H-benzimidazol-2-yl]isoquinoline-3-carboxamide Traditional Name: N-[4-(1H-benzimidazol-2-ylcarbamoyl)-1H-benzimidazol-2-yl]isoquinoline-3-carboxamide Formula: C25H17N7O2 MolecularWeight: 447.44818

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=NC(=CC2=C1)C(=O)NC3=NC4=C(C=CC=C4N3)C(=O)NC5=NC6=CC=CC=C6N5

Isomeric SMILES

C1=CC=C2C=NC(=CC2=C1)C(=O)NC3=NC4=C(C=CC=C4N3)C(=O)NC5=NC6=CC=CC=C6N5

InChI

InChI=1S/C25H17N7O2/c33-22(31-24-27-17-9-3-4-10-18(17)28-24)16-8-5-11-19-21(16)30-25(29-19)32-23(34)20-12-14-6-1-2-7-15(14)13-26-20/h1-13H,(H2,27,28,31,33)(H2,29,30,32,34)