1-ethylsulfonyl-N-[4-(trifluoromethyloxy)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 1-ethylsulfonyl-N-[4-(trifluoromethyloxy)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 1-ethylsulfonyl-N-[4-(trifluoromethoxy)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 1-ethylsulfonyl-N-[4-(trifluoromethoxy)phenyl]-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 1-ethylsulfonyl-N-[4-(trifluoromethoxy)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: (1-esylpyrazolo[3,4-d]pyrimidin-4-yl)-[4-(trifluoromethoxy)phenyl]amine Formula: C14H12F3N5O3S MolecularWeight: 387.33699

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1C2=C(C=N1)C(=NC=N2)NC3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

CCS(=O)(=O)N1C2=C(C=N1)C(=NC=N2)NC3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C14H12F3N5O3S/c1-2-26(23,24)22-13-11(7-20-22)12(18-8-19-13)21-9-3-5-10(6-4-9)25-14(15,16)17/h3-8H,2H2,1H3,(H,18,19,21)