N4-[1-(3-chlorophenyl)-6-propan-2-yl-pyrazolo[3,4-d]pyrimidin-4-yl]cyclohexane-1,4-diamine

Systemtic Name: N4-[1-(3-chlorophenyl)-6-propan-2-yl-pyrazolo[3,4-d]pyrimidin-4-yl]cyclohexane-1,4-diamine Openeye Name: N4-[1-(3-chlorophenyl)-6-isopropyl-pyrazolo[3,4-d]pyrimidin-4-yl]cyclohexane-1,4-diamine CAS Name: N4-[1-(3-chlorophenyl)-6-propan-2-yl-4-pyrazolo[3,4-d]pyrimidinyl]cyclohexane-1,4-diamine IUPAC Name: 4-N-[1-(3-chlorophenyl)-6-propan-2-ylpyrazolo[3,4-d]pyrimidin-4-yl]cyclohexane-1,4-diamine Traditional Name: (4-aminocyclohexyl)-[1-(3-chlorophenyl)-6-isopropyl-pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C20H25ClN6 MolecularWeight: 384.9057

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=C(C=NN2C3=CC(=CC=C3)Cl)C(=N1)NC4CCC(CC4)N

Isomeric SMILES

CC(C)C1=NC2=C(C=NN2C3=CC(=CC=C3)Cl)C(=N1)NC4CCC(CC4)N

InChI

InChI=1S/C20H25ClN6/c1-12(2)18-25-19(24-15-8-6-14(22)7-9-15)17-11-23-27(20(17)26-18)16-5-3-4-13(21)10-16/h3-5,10-12,14-15H,6-9,22H2,1-2H3,(H,24,25,26)