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

Systemtic Name: N4-(3-chlorophenyl)-1-methyl-N6-propyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine Openeye Name: N4-(3-chlorophenyl)-1-methyl-N6-propyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine CAS Name: N4-(3-chlorophenyl)-1-methyl-N6-propylpyrazolo[3,4-d]pyrimidine-4,6-diamine IUPAC Name: 4-N-(3-chlorophenyl)-1-methyl-6-N-propylpyrazolo[3,4-d]pyrimidine-4,6-diamine Traditional Name: [4-(3-chloroanilino)-1-methyl-pyrazolo[3,4-d]pyrimidin-6-yl]-propyl-amine Formula: C15H17ClN6 MolecularWeight: 316.78868

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=NC2=C(C=NN2C)C(=N1)NC3=CC(=CC=C3)Cl

Isomeric SMILES

CCCNC1=NC2=C(C=NN2C)C(=N1)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C15H17ClN6/c1-3-7-17-15-20-13(12-9-18-22(2)14(12)21-15)19-11-6-4-5-10(16)8-11/h4-6,8-9H,3,7H2,1-2H3,(H2,17,19,20,21)