2-(4-azanyl-5,6-dimethyl-pyrrolo[2,3-d]pyrimidin-7-yl)-6-fluoranyl-benzenecarbonitrile

Systemtic Name: 2-(4-azanyl-5,6-dimethyl-pyrrolo[2,3-d]pyrimidin-7-yl)-6-fluoranyl-benzenecarbonitrile Openeye Name: 2-(4-amino-5,6-dimethyl-pyrrolo[2,3-d]pyrimidin-7-yl)-6-fluoro-benzonitrile CAS Name: 2-(4-amino-5,6-dimethyl-7-pyrrolo[2,3-d]pyrimidinyl)-6-fluorobenzonitrile IUPAC Name: 2-(4-amino-5,6-dimethylpyrrolo[2,3-d]pyrimidin-7-yl)-6-fluorobenzonitrile Traditional Name: 2-(4-amino-5,6-dimethyl-pyrrolo[2,3-d]pyrimidin-7-yl)-6-fluoro-benzonitrile Formula: C15H12FN5 MolecularWeight: 281.287683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C(=NC=N2)N)C3=C(C(=CC=C3)F)C#N)C

Isomeric SMILES

CC1=C(N(C2=C1C(=NC=N2)N)C3=C(C(=CC=C3)F)C#N)C

InChI

InChI=1S/C15H12FN5/c1-8-9(2)21(15-13(8)14(18)19-7-20-15)12-5-3-4-11(16)10(12)6-17/h3-5,7H,1-2H3,(H2,18,19,20)