3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazol-1-yl]pentanenitrile

Systemtic Name: 3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazol-1-yl]pentanenitrile Openeye Name: 3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazol-1-yl]pentanenitrile CAS Name: 3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1-pyrazolyl]pentanenitrile IUPAC Name: 3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazol-1-yl]pentanenitrile Traditional Name: 3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazol-1-yl]valeronitrile Formula: C14H14N6 MolecularWeight: 266.30116

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC#N)N1C=C(C=N1)C2=C3C=CNC3=NC=N2

Isomeric SMILES

CCC(CC#N)N1C=C(C=N1)C2=C3C=CNC3=NC=N2

InChI

InChI=1S/C14H14N6/c1-2-11(3-5-15)20-8-10(7-19-20)13-12-4-6-16-14(12)18-9-17-13/h4,6-9,11H,2-3H2,1H3,(H,16,17,18)