[5-azanyl-6-(phenylmethyl)pyrazin-2-yl] tris(fluoranyl)methanesulfonate

Systemtic Name: [5-azanyl-6-(phenylmethyl)pyrazin-2-yl] tris(fluoranyl)methanesulfonate Openeye Name: (5-amino-6-benzyl-pyrazin-2-yl) trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [5-amino-6-(phenylmethyl)-2-pyrazinyl] ester IUPAC Name: (5-amino-6-benzylpyrazin-2-yl) trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid (5-amino-6-benzyl-pyrazin-2-yl) ester Formula: C12H10F3N3O3S MolecularWeight: 333.28631

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NC(=CN=C2N)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CC2=NC(=CN=C2N)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C12H10F3N3O3S/c13-12(14,15)22(19,20)21-10-7-17-11(16)9(18-10)6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H2,16,17)