3-(4-phenethyl-1,2,3-triazol-1-yl)-1-propan-2-yl-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 3-(4-phenethyl-1,2,3-triazol-1-yl)-1-propan-2-yl-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 1-isopropyl-3-(4-phenethyltriazol-1-yl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 3-(4-phenethyl-1-triazolyl)-1-propan-2-yl-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 3-(4-phenethyltriazol-1-yl)-1-propan-2-ylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [1-isopropyl-3-(4-phenethyltriazol-1-yl)pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C18H20N8 MolecularWeight: 348.405

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C(=NC=N2)N)C(=N1)N3C=C(N=N3)CCC4=CC=CC=C4

Isomeric SMILES

CC(C)N1C2=C(C(=NC=N2)N)C(=N1)N3C=C(N=N3)CCC4=CC=CC=C4

InChI

InChI=1S/C18H20N8/c1-12(2)26-17-15(16(19)20-11-21-17)18(23-26)25-10-14(22-24-25)9-8-13-6-4-3-5-7-13/h3-7,10-12H,8-9H2,1-2H3,(H2,19,20,21)