N4-(3-chloranyl-4-methoxy-phenyl)-N6-cyclopentyl-1-methyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine

Systemtic Name: N4-(3-chloranyl-4-methoxy-phenyl)-N6-cyclopentyl-1-methyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine Openeye Name: N4-(3-chloro-4-methoxy-phenyl)-N6-cyclopentyl-1-methyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine CAS Name: N4-(3-chloro-4-methoxyphenyl)-N6-cyclopentyl-1-methylpyrazolo[3,4-d]pyrimidine-4,6-diamine IUPAC Name: 4-N-(3-chloro-4-methoxyphenyl)-6-N-cyclopentyl-1-methylpyrazolo[3,4-d]pyrimidine-4,6-diamine Traditional Name: [4-(3-chloro-4-methoxy-anilino)-1-methyl-pyrazolo[3,4-d]pyrimidin-6-yl]-cyclopentyl-amine Formula: C18H21ClN6O MolecularWeight: 372.85194

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC(=N2)NC3CCCC3)NC4=CC(=C(C=C4)OC)Cl

Isomeric SMILES

CN1C2=C(C=N1)C(=NC(=N2)NC3CCCC3)NC4=CC(=C(C=C4)OC)Cl

InChI

InChI=1S/C18H21ClN6O/c1-25-17-13(10-20-25)16(21-12-7-8-15(26-2)14(19)9-12)23-18(24-17)22-11-5-3-4-6-11/h7-11H,3-6H2,1-2H3,(H2,21,22,23,24)