2-[2-methoxy-3-[5-[(E)-N'-oxidanylcarbamimidoyl]pyridin-2-yl]phenyl]-N'-oxidanyl-3H-benzimidazole-5-carboximidamide

Systemtic Name: 2-[2-methoxy-3-[5-[(E)-N'-oxidanylcarbamimidoyl]pyridin-2-yl]phenyl]-N'-oxidanyl-3H-benzimidazole-5-carboximidamide Openeye Name: N'-hydroxy-2-[3-[5-[(E)-N'-hydroxycarbamimidoyl]-2-pyridyl]-2-methoxy-phenyl]-3H-benzimidazole-5-carboxamidine CAS Name: 2-[3-[5-[(E)-amino(hydroxyimino)methyl]-2-pyridinyl]-2-methoxyphenyl]-N'-hydroxy-3H-benzimidazole-5-carboximidamide IUPAC Name: N'-hydroxy-2-[3-[5-[(E)-N'-hydroxycarbamimidoyl]pyridin-2-yl]-2-methoxyphenyl]-3H-benzimidazole-5-carboximidamide Traditional Name: 2-[3-[5-[(E)-aminocarbohydroximoyl]-2-pyridyl]-2-methoxy-phenyl]-N'-hydroxy-3H-benzimidazole-5-carboxamidine Formula: C21H19N7O3 MolecularWeight: 417.42066

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC=C1C2=NC3=C(N2)C=C(C=C3)C(=NO)N)C4=NC=C(C=C4)C(=NO)N

Isomeric SMILES

COC1=C(C=CC=C1C2=NC3=C(N2)C=C(C=C3)/C(=N\O)/N)C4=NC=C(C=C4)/C(=N\O)/N

InChI

InChI=1S/C21H19N7O3/c1-31-18-13(15-7-6-12(10-24-15)20(23)28-30)3-2-4-14(18)21-25-16-8-5-11(19(22)27-29)9-17(16)26-21/h2-10,29-30H,1H3,(H2,22,27)(H2,23,28)(H,25,26)