N-cyclohexyl-2-[1-(4-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl-N-methyl-ethanamide

Systemtic Name: N-cyclohexyl-2-[1-(4-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl-N-methyl-ethanamide Openeye Name: N-cyclohexyl-2-[1-(4-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl-N-methyl-acetamide CAS Name: N-cyclohexyl-2-[[1-(4-fluorophenyl)-4-pyrazolo[3,4-d]pyrimidinyl]thio]-N-methylacetamide IUPAC Name: N-cyclohexyl-2-[1-(4-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl-N-methylacetamide Traditional Name: N-cyclohexyl-2-[[1-(4-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]thio]-N-methyl-acetamide Formula: C20H22FN5OS MolecularWeight: 399.484983

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C(=O)CSC2=NC=NC3=C2C=NN3C4=CC=C(C=C4)F

Isomeric SMILES

CN(C1CCCCC1)C(=O)CSC2=NC=NC3=C2C=NN3C4=CC=C(C=C4)F

InChI

InChI=1S/C20H22FN5OS/c1-25(15-5-3-2-4-6-15)18(27)12-28-20-17-11-24-26(19(17)22-13-23-20)16-9-7-14(21)8-10-16/h7-11,13,15H,2-6,12H2,1H3