1-cyclopentyl-3-ethyl-6-(3-imidazol-1-ylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 1-cyclopentyl-3-ethyl-6-(3-imidazol-1-ylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 1-cyclopentyl-3-ethyl-6-(3-imidazol-1-ylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 1-cyclopentyl-3-ethyl-6-[3-(1-imidazolyl)phenyl]-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 1-cyclopentyl-3-ethyl-6-(3-imidazol-1-ylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [1-cyclopentyl-3-ethyl-6-(3-imidazol-1-ylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C21H23N7 MolecularWeight: 373.45422

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C2=C1C(=NC(=N2)C3=CC(=CC=C3)N4C=CN=C4)N)C5CCCC5

Isomeric SMILES

CCC1=NN(C2=C1C(=NC(=N2)C3=CC(=CC=C3)N4C=CN=C4)N)C5CCCC5

InChI

InChI=1S/C21H23N7/c1-2-17-18-19(22)24-20(25-21(18)28(26-17)15-7-3-4-8-15)14-6-5-9-16(12-14)27-11-10-23-13-27/h5-6,9-13,15H,2-4,7-8H2,1H3,(H2,22,24,25)