N4-(3-chloranyl-4-methoxy-phenyl)-N6-(2-methoxyethyl)-1-methyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine

Systemtic Name: N4-(3-chloranyl-4-methoxy-phenyl)-N6-(2-methoxyethyl)-1-methyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine Openeye Name: N4-(3-chloro-4-methoxy-phenyl)-N6-(2-methoxyethyl)-1-methyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine CAS Name: N4-(3-chloro-4-methoxyphenyl)-N6-(2-methoxyethyl)-1-methylpyrazolo[3,4-d]pyrimidine-4,6-diamine IUPAC Name: 4-N-(3-chloro-4-methoxyphenyl)-6-N-(2-methoxyethyl)-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]-(2-methoxyethyl)amine Formula: C16H19ClN6O2 MolecularWeight: 362.81406

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC(=N2)NCCOC)NC3=CC(=C(C=C3)OC)Cl

Isomeric SMILES

CN1C2=C(C=N1)C(=NC(=N2)NCCOC)NC3=CC(=C(C=C3)OC)Cl

InChI

InChI=1S/C16H19ClN6O2/c1-23-15-11(9-19-23)14(21-16(22-15)18-6-7-24-2)20-10-4-5-13(25-3)12(17)8-10/h4-5,8-9H,6-7H2,1-3H3,(H2,18,20,21,22)