N-(4-butylphenyl)-2-(6-chloranyl-3,4-dimethyl-pyrazolo[3,4-b]pyridin-1-yl)-5-ethyl-6-methyl-pyrimidin-4-amine

Systemtic Name: N-(4-butylphenyl)-2-(6-chloranyl-3,4-dimethyl-pyrazolo[3,4-b]pyridin-1-yl)-5-ethyl-6-methyl-pyrimidin-4-amine Openeye Name: N-(4-butylphenyl)-2-(6-chloro-3,4-dimethyl-pyrazolo[3,4-b]pyridin-1-yl)-5-ethyl-6-methyl-pyrimidin-4-amine CAS Name: N-(4-butylphenyl)-2-(6-chloro-3,4-dimethyl-1-pyrazolo[3,4-b]pyridinyl)-5-ethyl-6-methyl-4-pyrimidinamine IUPAC Name: N-(4-butylphenyl)-2-(6-chloro-3,4-dimethylpyrazolo[3,4-b]pyridin-1-yl)-5-ethyl-6-methylpyrimidin-4-amine Traditional Name: (4-butylphenyl)-[2-(6-chloro-3,4-dimethyl-pyrazolo[3,4-b]pyridin-1-yl)-5-ethyl-6-methyl-pyrimidin-4-yl]amine Formula: C25H29ClN6 MolecularWeight: 448.99096

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=NC(=NC(=C2CC)C)N3C4=C(C(=CC(=N4)Cl)C)C(=N3)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=NC(=NC(=C2CC)C)N3C4=C(C(=CC(=N4)Cl)C)C(=N3)C

InChI

InChI=1S/C25H29ClN6/c1-6-8-9-18-10-12-19(13-11-18)28-23-20(7-2)16(4)27-25(30-23)32-24-22(17(5)31-32)15(3)14-21(26)29-24/h10-14H,6-9H2,1-5H3,(H,27,28,30)