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

Systemtic Name: N4-[(2-methoxyphenyl)methyl]-1-methyl-N6-propyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine Openeye Name: N4-[(2-methoxyphenyl)methyl]-1-methyl-N6-propyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine CAS Name: N4-[(2-methoxyphenyl)methyl]-1-methyl-N6-propylpyrazolo[3,4-d]pyrimidine-4,6-diamine IUPAC Name: 4-N-[(2-methoxyphenyl)methyl]-1-methyl-6-N-propylpyrazolo[3,4-d]pyrimidine-4,6-diamine Traditional Name: [1-methyl-4-(o-anisylamino)pyrazolo[3,4-d]pyrimidin-6-yl]-propyl-amine Formula: C17H22N6O MolecularWeight: 326.39618

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=NC2=C(C=NN2C)C(=N1)NCC3=CC=CC=C3OC

Isomeric SMILES

CCCNC1=NC2=C(C=NN2C)C(=N1)NCC3=CC=CC=C3OC

InChI

InChI=1S/C17H22N6O/c1-4-9-18-17-21-15(13-11-20-23(2)16(13)22-17)19-10-12-7-5-6-8-14(12)24-3/h5-8,11H,4,9-10H2,1-3H3,(H2,18,19,21,22)