3-ethyl-N-[(1-oxidanylpyridin-1-ium-3-yl)methyl]-5-propan-2-yl-pyrazolo[1,5-a]pyrimidin-7-amine

Systemtic Name: 3-ethyl-N-[(1-oxidanylpyridin-1-ium-3-yl)methyl]-5-propan-2-yl-pyrazolo[1,5-a]pyrimidin-7-amine Openeye Name: 3-ethyl-N-[(1-hydroxypyridin-1-ium-3-yl)methyl]-5-isopropyl-pyrazolo[1,5-a]pyrimidin-7-amine CAS Name: 3-ethyl-N-[(1-hydroxy-3-pyridin-1-iumyl)methyl]-5-propan-2-yl-7-pyrazolo[1,5-a]pyrimidinamine IUPAC Name: 3-ethyl-N-[(1-hydroxypyridin-1-ium-3-yl)methyl]-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine Traditional Name: (3-ethyl-5-isopropyl-pyrazolo[1,5-a]pyrimidin-7-yl)-[(1-hydroxypyridin-1-ium-3-yl)methyl]amine Formula: C17H22N5O+ MolecularWeight: 312.38948

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2N=C(C=C(N2N=C1)NCC3=C[N+](=CC=C3)O)C(C)C

Isomeric SMILES

CCC1=C2N=C(C=C(N2N=C1)NCC3=C[N+](=CC=C3)O)C(C)C

InChI

InChI=1S/C17H22N5O/c1-4-14-10-19-22-16(8-15(12(2)3)20-17(14)22)18-9-13-6-5-7-21(23)11-13/h5-8,10-12,18,23H,4,9H2,1-3H3/q+1