3-azanyl-6-[3,5-bis(trifluoromethyl)phenyl]pyrazine-2-carbonitrile

Systemtic Name: 3-azanyl-6-[3,5-bis(trifluoromethyl)phenyl]pyrazine-2-carbonitrile Openeye Name: 3-amino-6-[3,5-bis(trifluoromethyl)phenyl]pyrazine-2-carbonitrile CAS Name: 3-amino-6-[3,5-bis(trifluoromethyl)phenyl]-2-pyrazinecarbonitrile IUPAC Name: 3-amino-6-[3,5-bis(trifluoromethyl)phenyl]pyrazine-2-carbonitrile Traditional Name: 3-amino-6-[3,5-bis(trifluoromethyl)phenyl]pyrazinonitrile Formula: C13H6F6N4 MolecularWeight: 332.203959

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C2=CN=C(C(=N2)C#N)N

Isomeric SMILES

C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C2=CN=C(C(=N2)C#N)N

InChI

InChI=1S/C13H6F6N4/c14-12(15,16)7-1-6(2-8(3-7)13(17,18)19)10-5-22-11(21)9(4-20)23-10/h1-3,5H,(H2,21,22)