5-[6-(4-carbamimidoylphenyl)pyridin-3-yl]furan-2-carboximidamide ethanoate

Systemtic Name: 5-[6-(4-carbamimidoylphenyl)pyridin-3-yl]furan-2-carboximidamide ethanoate Openeye Name: 5-[6-(4-carbamimidoylphenyl)-3-pyridyl]furan-2-carboxamidine acetate CAS Name: 5-[6-(4-carbamimidoylphenyl)-3-pyridinyl]-2-furancarboximidamide acetate IUPAC Name: 5-[6-(4-carbamimidoylphenyl)pyridin-3-yl]furan-2-carboximidamide acetate Traditional Name: 5-[6-(4-amidinophenyl)-3-pyridyl]furan-2-carboxamidine acetate Formula: C19H18N5O3- MolecularWeight: 364.37792

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)[O-].C1=CC(=CC=C1C2=NC=C(C=C2)C3=CC=C(O3)C(=N)N)C(=N)N

Isomeric SMILES

CC(=O)[O-].C1=CC(=CC=C1C2=NC=C(C=C2)C3=CC=C(O3)C(=N)N)C(=N)N

InChI

InChI=1S/C17H15N5O.C2H4O2/c18-16(19)11-3-1-10(2-4-11)13-6-5-12(9-22-13)14-7-8-15(23-14)17(20)21;1-2(3)4/h1-9H,(H3,18,19)(H3,20,21);1H3,(H,3,4)/p-1