7-(2,2-dimethylpropyl)-6-[(1'-ethyl-5-fluoranyl-2-oxidanylidene-spiro[indole-3,4'-piperidine]-1-yl)methyl]pyrrolo[2,3-d]pyrimidine-2-carbonitrile

Systemtic Name: 7-(2,2-dimethylpropyl)-6-[(1'-ethyl-5-fluoranyl-2-oxidanylidene-spiro[indole-3,4'-piperidine]-1-yl)methyl]pyrrolo[2,3-d]pyrimidine-2-carbonitrile Openeye Name: 7-(2,2-dimethylpropyl)-6-[(1'-ethyl-5-fluoro-2-oxo-spiro[indoline-3,4'-piperidine]-1-yl)methyl]pyrrolo[2,3-d]pyrimidine-2-carbonitrile CAS Name: 7-(2,2-dimethylpropyl)-6-[(1'-ethyl-5-fluoro-2-oxo-1-spiro[indole-3,4'-piperidine]yl)methyl]-2-pyrrolo[2,3-d]pyrimidinecarbonitrile IUPAC Name: 7-(2,2-dimethylpropyl)-6-[(1'-ethyl-5-fluoro-2-oxospiro[indole-3,4'-piperidine]-1-yl)methyl]pyrrolo[2,3-d]pyrimidine-2-carbonitrile Traditional Name: 6-[(1'-ethyl-5-fluoro-2-keto-spiro[indoline-3,4'-piperidine]-1-yl)methyl]-7-neopentyl-pyrrolo[2,3-d]pyrimidine-2-carbonitrile Formula: C27H31FN6O MolecularWeight: 474.573043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC2(CC1)C3=C(C=CC(=C3)F)N(C2=O)CC4=CC5=CN=C(N=C5N4CC(C)(C)C)C#N

Isomeric SMILES

CCN1CCC2(CC1)C3=C(C=CC(=C3)F)N(C2=O)CC4=CC5=CN=C(N=C5N4CC(C)(C)C)C#N

InChI

InChI=1S/C27H31FN6O/c1-5-32-10-8-27(9-11-32)21-13-19(28)6-7-22(21)33(25(27)35)16-20-12-18-15-30-23(14-29)31-24(18)34(20)17-26(2,3)4/h6-7,12-13,15H,5,8-11,16-17H2,1-4H3