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

Systemtic Name: 2-methyl-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazol-1-yl]propanenitrile Openeye Name: 2-methyl-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazol-1-yl]propanenitrile CAS Name: 2-methyl-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1-pyrazolyl]propanenitrile IUPAC Name: 2-methyl-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazol-1-yl]propanenitrile Traditional Name: 2-methyl-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazol-1-yl]propionitrile Formula: C13H12N6 MolecularWeight: 252.27458

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=C(C=N1)C2=C3C=CNC3=NC=N2)C#N

Isomeric SMILES

CC(CN1C=C(C=N1)C2=C3C=CNC3=NC=N2)C#N

InChI

InChI=1S/C13H12N6/c1-9(4-14)6-19-7-10(5-18-19)12-11-2-3-15-13(11)17-8-16-12/h2-3,5,7-9H,6H2,1H3,(H,15,16,17)