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

Systemtic Name: 3-(4-azanyl-5,6-dimethyl-pyrrolo[2,3-d]pyrimidin-7-yl)benzenecarbonitrile Openeye Name: 3-(4-amino-5,6-dimethyl-pyrrolo[2,3-d]pyrimidin-7-yl)benzonitrile CAS Name: 3-(4-amino-5,6-dimethyl-7-pyrrolo[2,3-d]pyrimidinyl)benzonitrile IUPAC Name: 3-(4-amino-5,6-dimethylpyrrolo[2,3-d]pyrimidin-7-yl)benzonitrile Traditional Name: 3-(4-amino-5,6-dimethyl-pyrrolo[2,3-d]pyrimidin-7-yl)benzonitrile Formula: C15H13N5 MolecularWeight: 263.29722

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13N5/c1-9-10(2)20(12-5-3-4-11(6-12)7-16)15-13(9)14(17)18-8-19-15/h3-6,8H,1-2H3,(H2,17,18,19)