4-[1-(5,5-dimethylhex-1-en-3-yl)pyrazol-4-yl]-7H-pyrrolo[2,3-d]pyrimidine

Systemtic Name: 4-[1-(5,5-dimethylhex-1-en-3-yl)pyrazol-4-yl]-7H-pyrrolo[2,3-d]pyrimidine Openeye Name: 4-[1-(3,3-dimethyl-1-vinyl-butyl)pyrazol-4-yl]-7H-pyrrolo[2,3-d]pyrimidine CAS Name: 4-[1-(5,5-dimethylhex-1-en-3-yl)-4-pyrazolyl]-7H-pyrrolo[2,3-d]pyrimidine IUPAC Name: 4-[1-(5,5-dimethylhex-1-en-3-yl)pyrazol-4-yl]-7H-pyrrolo[2,3-d]pyrimidine Traditional Name: 4-[1-(1-neopentylallyl)pyrazol-4-yl]-7H-pyrrolo[2,3-d]pyrimidine Formula: C17H21N5 MolecularWeight: 295.38214

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21N5/c1-5-13(8-17(2,3)4)22-10-12(9-21-22)15-14-6-7-18-16(14)20-11-19-15/h5-7,9-11,13H,1,8H2,2-4H3,(H,18,19,20)