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

Systemtic Name: N6-(4-bromophenyl)-1-methyl-N4-(phenylmethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine Openeye Name: N4-benzyl-N6-(4-bromophenyl)-1-methyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine CAS Name: N6-(4-bromophenyl)-1-methyl-N4-(phenylmethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine IUPAC Name: 4-N-benzyl-6-N-(4-bromophenyl)-1-methylpyrazolo[3,4-d]pyrimidine-4,6-diamine Traditional Name: benzyl-[6-(4-bromoanilino)-1-methyl-pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C19H17BrN6 MolecularWeight: 409.28248

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC(=N2)NC3=CC=C(C=C3)Br)NCC4=CC=CC=C4

Isomeric SMILES

CN1C2=C(C=N1)C(=NC(=N2)NC3=CC=C(C=C3)Br)NCC4=CC=CC=C4

InChI

InChI=1S/C19H17BrN6/c1-26-18-16(12-22-26)17(21-11-13-5-3-2-4-6-13)24-19(25-18)23-15-9-7-14(20)8-10-15/h2-10,12H,11H2,1H3,(H2,21,23,24,25)