5-[3,5-bis(trifluoromethyl)phenyl]-4-piperidin-1-yl-7H-pyrrolo[2,3-d]pyrimidine

Systemtic Name: 5-[3,5-bis(trifluoromethyl)phenyl]-4-piperidin-1-yl-7H-pyrrolo[2,3-d]pyrimidine Openeye Name: 5-[3,5-bis(trifluoromethyl)phenyl]-4-(1-piperidyl)-7H-pyrrolo[2,3-d]pyrimidine CAS Name: 5-[3,5-bis(trifluoromethyl)phenyl]-4-(1-piperidinyl)-7H-pyrrolo[2,3-d]pyrimidine IUPAC Name: 5-[3,5-bis(trifluoromethyl)phenyl]-4-piperidin-1-yl-7H-pyrrolo[2,3-d]pyrimidine Traditional Name: 5-[3,5-bis(trifluoromethyl)phenyl]-4-piperidino-7H-pyrrolo[2,3-d]pyrimidine Formula: C19H16F6N4 MolecularWeight: 414.347559

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC=NC3=C2C(=CN3)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1CCN(CC1)C2=NC=NC3=C2C(=CN3)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C19H16F6N4/c20-18(21,22)12-6-11(7-13(8-12)19(23,24)25)14-9-26-16-15(14)17(28-10-27-16)29-4-2-1-3-5-29/h6-10H,1-5H2,(H,26,27,28)