N,N-diethyl-2-[1-(2-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl-ethanamide

Systemtic Name: N,N-diethyl-2-[1-(2-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl-ethanamide Openeye Name: N,N-diethyl-2-[1-(o-tolyl)pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl-acetamide CAS Name: N,N-diethyl-2-[[1-(2-methylphenyl)-4-pyrazolo[3,4-d]pyrimidinyl]thio]acetamide IUPAC Name: N,N-diethyl-2-[1-(2-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]sulfanylacetamide Traditional Name: N,N-diethyl-2-[[1-(o-tolyl)pyrazolo[3,4-d]pyrimidin-4-yl]thio]acetamide Formula: C18H21N5OS MolecularWeight: 355.45724

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CSC1=NC=NC2=C1C=NN2C3=CC=CC=C3C

Isomeric SMILES

CCN(CC)C(=O)CSC1=NC=NC2=C1C=NN2C3=CC=CC=C3C

InChI

InChI=1S/C18H21N5OS/c1-4-22(5-2)16(24)11-25-18-14-10-21-23(17(14)19-12-20-18)15-9-7-6-8-13(15)3/h6-10,12H,4-5,11H2,1-3H3