2-[(4,5-dimethyl-1,2,4-triazol-3-yl)methylamino]-6-fluoranyl-benzenecarbonitrile

Systemtic Name: 2-[(4,5-dimethyl-1,2,4-triazol-3-yl)methylamino]-6-fluoranyl-benzenecarbonitrile Openeye Name: 2-[(4,5-dimethyl-1,2,4-triazol-3-yl)methylamino]-6-fluoro-benzonitrile CAS Name: 2-[(4,5-dimethyl-1,2,4-triazol-3-yl)methylamino]-6-fluorobenzonitrile IUPAC Name: 2-[(4,5-dimethyl-1,2,4-triazol-3-yl)methylamino]-6-fluorobenzonitrile Traditional Name: 2-[(4,5-dimethyl-1,2,4-triazol-3-yl)methylamino]-6-fluoro-benzonitrile Formula: C12H12FN5 MolecularWeight: 245.255583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C)CNC2=C(C(=CC=C2)F)C#N

Isomeric SMILES

CC1=NN=C(N1C)CNC2=C(C(=CC=C2)F)C#N

InChI

InChI=1S/C12H12FN5/c1-8-16-17-12(18(8)2)7-15-11-5-3-4-10(13)9(11)6-14/h3-5,15H,7H2,1-2H3