8-[5-phenyl-7-[3-(trifluoromethyl)phenyl]pyrrolo[2,3-d]pyrimidin-4-yl]-1,4-dioxa-8-azaspiro[4.5]decane

Systemtic Name: 8-[5-phenyl-7-[3-(trifluoromethyl)phenyl]pyrrolo[2,3-d]pyrimidin-4-yl]-1,4-dioxa-8-azaspiro[4.5]decane Openeye Name: 8-[5-phenyl-7-[3-(trifluoromethyl)phenyl]pyrrolo[2,3-d]pyrimidin-4-yl]-1,4-dioxa-8-azaspiro[4.5]decane CAS Name: 8-[5-phenyl-7-[3-(trifluoromethyl)phenyl]-4-pyrrolo[2,3-d]pyrimidinyl]-1,4-dioxa-8-azaspiro[4.5]decane IUPAC Name: 8-[5-phenyl-7-[3-(trifluoromethyl)phenyl]pyrrolo[2,3-d]pyrimidin-4-yl]-1,4-dioxa-8-azaspiro[4.5]decane Traditional Name: 8-[5-phenyl-7-[3-(trifluoromethyl)phenyl]pyrrolo[2,3-d]pyrimidin-4-yl]-1,4-dioxa-8-azaspiro[4.5]decane Formula: C26H23F3N4O2 MolecularWeight: 480.48163

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12OCCO2)C3=NC=NC4=C3C(=CN4C5=CC=CC(=C5)C(F)(F)F)C6=CC=CC=C6

Isomeric SMILES

C1CN(CCC12OCCO2)C3=NC=NC4=C3C(=CN4C5=CC=CC(=C5)C(F)(F)F)C6=CC=CC=C6

InChI

InChI=1S/C26H23F3N4O2/c27-26(28,29)19-7-4-8-20(15-19)33-16-21(18-5-2-1-3-6-18)22-23(30-17-31-24(22)33)32-11-9-25(10-12-32)34-13-14-35-25/h1-8,15-17H,9-14H2