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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C1C(=NC=N2)NC3=CC=CC(=C3)C#N)C

Isomeric SMILES

CC1=C(NC2=C1C(=NC=N2)NC3=CC=CC(=C3)C#N)C

InChI

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