5-(4-methoxyphenyl)-3-methyl-6-(pyridin-2-ylmethylsulfanyl)pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 5-(4-methoxyphenyl)-3-methyl-6-(pyridin-2-ylmethylsulfanyl)pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 5-(4-methoxyphenyl)-3-methyl-6-(2-pyridylmethylsulfanyl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 5-(4-methoxyphenyl)-3-methyl-6-(2-pyridinylmethylthio)-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 5-(4-methoxyphenyl)-3-methyl-6-(pyridin-2-ylmethylsulfanyl)pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [5-(4-methoxyphenyl)-3-methyl-6-(2-pyridylmethylthio)pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C19H18N6OS MolecularWeight: 378.45082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C2C1=C(N(C(=N2)SCC3=CC=CC=N3)C4=CC=C(C=C4)OC)N

Isomeric SMILES

CC1=NN=C2C1=C(N(C(=N2)SCC3=CC=CC=N3)C4=CC=C(C=C4)OC)N

InChI

InChI=1S/C19H18N6OS/c1-12-16-17(20)25(14-6-8-15(26-2)9-7-14)19(22-18(16)24-23-12)27-11-13-5-3-4-10-21-13/h3-10H,11,20H2,1-2H3