4,5-dimethyl-N2-[1-(phenylmethyl)pyrazolo[3,4-d]pyrimidin-4-yl]benzene-1,2-diamine

Systemtic Name: 4,5-dimethyl-N2-[1-(phenylmethyl)pyrazolo[3,4-d]pyrimidin-4-yl]benzene-1,2-diamine Openeye Name: N2-(1-benzylpyrazolo[3,4-d]pyrimidin-4-yl)-4,5-dimethyl-benzene-1,2-diamine CAS Name: 4,5-dimethyl-N2-[1-(phenylmethyl)-4-pyrazolo[3,4-d]pyrimidinyl]benzene-1,2-diamine IUPAC Name: 2-N-(1-benzylpyrazolo[3,4-d]pyrimidin-4-yl)-4,5-dimethylbenzene-1,2-diamine Traditional Name: (2-amino-4,5-dimethyl-phenyl)-(1-benzylpyrazolo[3,4-d]pyrimidin-4-yl)amine Formula: C20H20N6 MolecularWeight: 344.413

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)NC2=NC=NC3=C2C=NN3CC4=CC=CC=C4)N

Isomeric SMILES

CC1=CC(=C(C=C1C)NC2=NC=NC3=C2C=NN3CC4=CC=CC=C4)N

InChI

InChI=1S/C20H20N6/c1-13-8-17(21)18(9-14(13)2)25-19-16-10-24-26(20(16)23-12-22-19)11-15-6-4-3-5-7-15/h3-10,12H,11,21H2,1-2H3,(H,22,23,25)