3-bromanyl-5-(2-fluorophenyl)-N-[(6-methoxy-1-oxidanidyl-pyridin-1-ium-3-yl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine

Systemtic Name: 3-bromanyl-5-(2-fluorophenyl)-N-[(6-methoxy-1-oxidanidyl-pyridin-1-ium-3-yl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine Openeye Name: 3-bromo-5-(2-fluorophenyl)-N-[(6-methoxy-1-oxido-pyridin-1-ium-3-yl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine CAS Name: 3-bromo-5-(2-fluorophenyl)-N-[(6-methoxy-1-oxido-3-pyridin-1-iumyl)methyl]-7-pyrazolo[1,5-a]pyrimidinamine IUPAC Name: 3-bromo-5-(2-fluorophenyl)-N-[(6-methoxy-1-oxidopyridin-1-ium-3-yl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine Traditional Name: [3-bromo-5-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]-[(6-methoxy-1-oxido-pyridin-1-ium-3-yl)methyl]amine Formula: C19H15BrFN5O2 MolecularWeight: 444.257103

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=[N+](C=C(C=C1)CNC2=CC(=NC3=C(C=NN23)Br)C4=CC=CC=C4F)[O-]

Isomeric SMILES

COC1=[N+](C=C(C=C1)CNC2=CC(=NC3=C(C=NN23)Br)C4=CC=CC=C4F)[O-]

InChI

InChI=1S/C19H15BrFN5O2/c1-28-18-7-6-12(11-25(18)27)9-22-17-8-16(13-4-2-3-5-15(13)21)24-19-14(20)10-23-26(17)19/h2-8,10-11,22H,9H2,1H3