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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14N6/c1-14(2,4-5-15)20-8-10(7-19-20)12-11-3-6-16-13(11)18-9-17-12/h3,6-9H,4H2,1-2H3,(H,16,17,18)