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

Systemtic Name: N-(4-ethylphenyl)-2-[1-(2-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl-ethanamide Openeye Name: N-(4-ethylphenyl)-2-[1-(o-tolyl)pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl-acetamide CAS Name: N-(4-ethylphenyl)-2-[[1-(2-methylphenyl)-4-pyrazolo[3,4-d]pyrimidinyl]thio]acetamide IUPAC Name: N-(4-ethylphenyl)-2-[1-(2-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]sulfanylacetamide Traditional Name: N-(4-ethylphenyl)-2-[[1-(o-tolyl)pyrazolo[3,4-d]pyrimidin-4-yl]thio]acetamide Formula: C22H21N5OS MolecularWeight: 403.50004

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)CSC2=NC=NC3=C2C=NN3C4=CC=CC=C4C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)CSC2=NC=NC3=C2C=NN3C4=CC=CC=C4C

InChI

InChI=1S/C22H21N5OS/c1-3-16-8-10-17(11-9-16)26-20(28)13-29-22-18-12-25-27(21(18)23-14-24-22)19-7-5-4-6-15(19)2/h4-12,14H,3,13H2,1-2H3,(H,26,28)