N-[2-(1,3-benzodioxol-4-yl)ethyl]-2-(6-carbamimidoyl-1H-benzimidazol-2-yl)pyridine-3-carboxamide

Systemtic Name: N-[2-(1,3-benzodioxol-4-yl)ethyl]-2-(6-carbamimidoyl-1H-benzimidazol-2-yl)pyridine-3-carboxamide Openeye Name: N-[2-(1,3-benzodioxol-4-yl)ethyl]-2-(6-carbamimidoyl-1H-benzimidazol-2-yl)pyridine-3-carboxamide CAS Name: N-[2-(1,3-benzodioxol-4-yl)ethyl]-2-(6-carbamimidoyl-1H-benzimidazol-2-yl)-3-pyridinecarboxamide IUPAC Name: N-[2-(1,3-benzodioxol-4-yl)ethyl]-2-(6-carbamimidoyl-1H-benzimidazol-2-yl)pyridine-3-carboxamide Traditional Name: 2-(6-amidino-1H-benzimidazol-2-yl)-N-[2-(1,3-benzodioxol-4-yl)ethyl]nicotinamide Formula: C23H20N6O3 MolecularWeight: 428.4433

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=CC=CC(=C2O1)CCNC(=O)C3=C(N=CC=C3)C4=NC5=C(N4)C=C(C=C5)C(=N)N

Isomeric SMILES

C1OC2=CC=CC(=C2O1)CCNC(=O)C3=C(N=CC=C3)C4=NC5=C(N4)C=C(C=C5)C(=N)N

InChI

InChI=1S/C23H20N6O3/c24-21(25)14-6-7-16-17(11-14)29-22(28-16)19-15(4-2-9-26-19)23(30)27-10-8-13-3-1-5-18-20(13)32-12-31-18/h1-7,9,11H,8,10,12H2,(H3,24,25)(H,27,30)(H,28,29)