N-(3-chloranyl-4-methyl-phenyl)-1-methyl-4-piperidin-1-yl-pyrazolo[3,4-d]pyrimidin-6-amine

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-1-methyl-4-piperidin-1-yl-pyrazolo[3,4-d]pyrimidin-6-amine Openeye Name: N-(3-chloro-4-methyl-phenyl)-1-methyl-4-(1-piperidyl)pyrazolo[3,4-d]pyrimidin-6-amine CAS Name: N-(3-chloro-4-methylphenyl)-1-methyl-4-(1-piperidinyl)-6-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-(3-chloro-4-methylphenyl)-1-methyl-4-piperidin-1-ylpyrazolo[3,4-d]pyrimidin-6-amine Traditional Name: (3-chloro-4-methyl-phenyl)-(1-methyl-4-piperidino-pyrazolo[3,4-d]pyrimidin-6-yl)amine Formula: C18H21ClN6 MolecularWeight: 356.85254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=NC3=C(C=NN3C)C(=N2)N4CCCCC4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=NC3=C(C=NN3C)C(=N2)N4CCCCC4)Cl

InChI

InChI=1S/C18H21ClN6/c1-12-6-7-13(10-15(12)19)21-18-22-16-14(11-20-24(16)2)17(23-18)25-8-4-3-5-9-25/h6-7,10-11H,3-5,8-9H2,1-2H3,(H,21,22,23)