N6-(2-chlorophenyl)-N4-(3-methoxypropyl)-1-methyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine

Systemtic Name: N6-(2-chlorophenyl)-N4-(3-methoxypropyl)-1-methyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine Openeye Name: N6-(2-chlorophenyl)-N4-(3-methoxypropyl)-1-methyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine CAS Name: N6-(2-chlorophenyl)-N4-(3-methoxypropyl)-1-methylpyrazolo[3,4-d]pyrimidine-4,6-diamine IUPAC Name: 6-N-(2-chlorophenyl)-4-N-(3-methoxypropyl)-1-methylpyrazolo[3,4-d]pyrimidine-4,6-diamine Traditional Name: [6-(2-chloroanilino)-1-methyl-pyrazolo[3,4-d]pyrimidin-4-yl]-(3-methoxypropyl)amine Formula: C16H19ClN6O MolecularWeight: 346.81466

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC(=N2)NC3=CC=CC=C3Cl)NCCCOC

Isomeric SMILES

CN1C2=C(C=N1)C(=NC(=N2)NC3=CC=CC=C3Cl)NCCCOC

InChI

InChI=1S/C16H19ClN6O/c1-23-15-11(10-19-23)14(18-8-5-9-24-2)21-16(22-15)20-13-7-4-3-6-12(13)17/h3-4,6-7,10H,5,8-9H2,1-2H3,(H2,18,20,21,22)