1-methyl-N4-(phenylmethyl)-N6-prop-2-enyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine

Systemtic Name: 1-methyl-N4-(phenylmethyl)-N6-prop-2-enyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine Openeye Name: N6-allyl-N4-benzyl-1-methyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine CAS Name: 1-methyl-N4-(phenylmethyl)-N6-prop-2-enylpyrazolo[3,4-d]pyrimidine-4,6-diamine IUPAC Name: 4-N-benzyl-1-methyl-6-N-prop-2-enylpyrazolo[3,4-d]pyrimidine-4,6-diamine Traditional Name: allyl-[4-(benzylamino)-1-methyl-pyrazolo[3,4-d]pyrimidin-6-yl]amine Formula: C16H18N6 MolecularWeight: 294.35432

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC(=N2)NCC=C)NCC3=CC=CC=C3

Isomeric SMILES

CN1C2=C(C=N1)C(=NC(=N2)NCC=C)NCC3=CC=CC=C3

InChI

InChI=1S/C16H18N6/c1-3-9-17-16-20-14(13-11-19-22(2)15(13)21-16)18-10-12-7-5-4-6-8-12/h3-8,11H,1,9-10H2,2H3,(H2,17,18,20,21)