N'-oxidanyl-3-[pyridin-3-ylmethyl(pyrimidin-2-yl)amino]propanimidamide

Systemtic Name: N'-oxidanyl-3-[pyridin-3-ylmethyl(pyrimidin-2-yl)amino]propanimidamide Openeye Name: N'-hydroxy-3-[3-pyridylmethyl(pyrimidin-2-yl)amino]propanamidine CAS Name: N'-hydroxy-3-[3-pyridinylmethyl(2-pyrimidinyl)amino]propanimidamide IUPAC Name: N'-hydroxy-3-[pyridin-3-ylmethyl(pyrimidin-2-yl)amino]propanimidamide Traditional Name: N'-hydroxy-3-[3-pyridylmethyl(2-pyrimidyl)amino]propionamidine Formula: C13H16N6O MolecularWeight: 272.30574

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CN(CCC(=NO)N)C2=NC=CC=N2

Isomeric SMILES

C1=CC(=CN=C1)CN(CC/C(=N/O)/N)C2=NC=CC=N2

InChI

InChI=1S/C13H16N6O/c14-12(18-20)4-8-19(13-16-6-2-7-17-13)10-11-3-1-5-15-9-11/h1-3,5-7,9,20H,4,8,10H2,(H2,14,18)