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

Systemtic Name: N6-(4-chlorophenyl)-N4-(3-methoxypropyl)-1-methyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine Openeye Name: N6-(4-chlorophenyl)-N4-(3-methoxypropyl)-1-methyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine CAS Name: N6-(4-chlorophenyl)-N4-(3-methoxypropyl)-1-methylpyrazolo[3,4-d]pyrimidine-4,6-diamine IUPAC Name: 6-N-(4-chlorophenyl)-4-N-(3-methoxypropyl)-1-methylpyrazolo[3,4-d]pyrimidine-4,6-diamine Traditional Name: [6-(4-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=C(C=C3)Cl)NCCCOC

Isomeric SMILES

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

InChI

InChI=1S/C16H19ClN6O/c1-23-15-13(10-19-23)14(18-8-3-9-24-2)21-16(22-15)20-12-6-4-11(17)5-7-12/h4-7,10H,3,8-9H2,1-2H3,(H2,18,20,21,22)