2-[5-(5-carbamimidoylpyridin-2-yl)-2-methoxy-phenyl]-3H-benzimidazole-5-carboximidamide

Systemtic Name: 2-[5-(5-carbamimidoylpyridin-2-yl)-2-methoxy-phenyl]-3H-benzimidazole-5-carboximidamide Openeye Name: 2-[5-(5-carbamimidoyl-2-pyridyl)-2-methoxy-phenyl]-3H-benzimidazole-5-carboxamidine CAS Name: 2-[5-(5-carbamimidoyl-2-pyridinyl)-2-methoxyphenyl]-3H-benzimidazole-5-carboximidamide IUPAC Name: 2-[5-(5-carbamimidoylpyridin-2-yl)-2-methoxyphenyl]-3H-benzimidazole-5-carboximidamide Traditional Name: 2-[5-(5-amidino-2-pyridyl)-2-methoxy-phenyl]-3H-benzimidazole-5-carboxamidine Formula: C21H19N7O MolecularWeight: 385.42186

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC=C(C=C2)C(=N)N)C3=NC4=C(N3)C=C(C=C4)C(=N)N

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC=C(C=C2)C(=N)N)C3=NC4=C(N3)C=C(C=C4)C(=N)N

InChI

InChI=1S/C21H19N7O/c1-29-18-7-4-11(15-5-3-13(10-26-15)20(24)25)8-14(18)21-27-16-6-2-12(19(22)23)9-17(16)28-21/h2-10H,1H3,(H3,22,23)(H3,24,25)(H,27,28)