4-[2-[(4-carbamimidoylphenyl)amino]-1-methyl-benzimidazol-5-yl]oxy-N-methyl-pyridine-2-carboxamide

Systemtic Name: 4-[2-[(4-carbamimidoylphenyl)amino]-1-methyl-benzimidazol-5-yl]oxy-N-methyl-pyridine-2-carboxamide Openeye Name: 4-[2-(4-carbamimidoylanilino)-1-methyl-benzimidazol-5-yl]oxy-N-methyl-pyridine-2-carboxamide CAS Name: 4-[[2-(4-carbamimidoylanilino)-1-methyl-5-benzimidazolyl]oxy]-N-methyl-2-pyridinecarboxamide IUPAC Name: 4-[2-(4-carbamimidoylanilino)-1-methylbenzimidazol-5-yl]oxy-N-methylpyridine-2-carboxamide Traditional Name: 4-[2-(4-amidinoanilino)-1-methyl-benzimidazol-5-yl]oxy-N-methyl-picolinamide Formula: C22H21N7O2 MolecularWeight: 415.44784

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=NC=CC(=C1)OC2=CC3=C(C=C2)N(C(=N3)NC4=CC=C(C=C4)C(=N)N)C

Isomeric SMILES

CNC(=O)C1=NC=CC(=C1)OC2=CC3=C(C=C2)N(C(=N3)NC4=CC=C(C=C4)C(=N)N)C

InChI

InChI=1S/C22H21N7O2/c1-25-21(30)18-12-16(9-10-26-18)31-15-7-8-19-17(11-15)28-22(29(19)2)27-14-5-3-13(4-6-14)20(23)24/h3-12H,1-2H3,(H3,23,24)(H,25,30)(H,27,28)