propan-2-yl 2-[1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]sulfanylethanoate

Systemtic Name: propan-2-yl 2-[1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]sulfanylethanoate Openeye Name: isopropyl 2-[1-(p-tolyl)pyrazolo[3,4-d]pyrimidin-4-yl]sulfanylacetate CAS Name: 2-[[1-(4-methylphenyl)-4-pyrazolo[3,4-d]pyrimidinyl]thio]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]sulfanylacetate Traditional Name: 2-[[1-(p-tolyl)pyrazolo[3,4-d]pyrimidin-4-yl]thio]acetic acid isopropyl ester Formula: C17H18N4O2S MolecularWeight: 342.41542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)SCC(=O)OC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)SCC(=O)OC(C)C

InChI

InChI=1S/C17H18N4O2S/c1-11(2)23-15(22)9-24-17-14-8-20-21(16(14)18-10-19-17)13-6-4-12(3)5-7-13/h4-8,10-11H,9H2,1-3H3