7-(2,2-dimethylpropyl)-6-[[1'-[(4-fluorophenyl)methyl]-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'-[(4-fluorophenyl)methyl]-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'-[(4-fluorophenyl)methyl]-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'-[(4-fluorophenyl)methyl]-2-oxo-1-spiro[indole-3,4'-piperidine]yl]methyl]-2-pyrrolo[2,3-d]pyrimidinecarbonitrile IUPAC Name: 7-(2,2-dimethylpropyl)-6-[[1'-[(4-fluorophenyl)methyl]-2-oxospiro[indole-3,4'-piperidine]-1-yl]methyl]pyrrolo[2,3-d]pyrimidine-2-carbonitrile Traditional Name: 6-[[1'-(4-fluorobenzyl)-2-keto-spiro[indoline-3,4'-piperidine]-1-yl]methyl]-7-neopentyl-pyrrolo[2,3-d]pyrimidine-2-carbonitrile Formula: C32H33FN6O MolecularWeight: 536.642423

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CN1C(=CC2=CN=C(N=C21)C#N)CN3C4=CC=CC=C4C5(C3=O)CCN(CC5)CC6=CC=C(C=C6)F

Isomeric SMILES

CC(C)(C)CN1C(=CC2=CN=C(N=C21)C#N)CN3C4=CC=CC=C4C5(C3=O)CCN(CC5)CC6=CC=C(C=C6)F

InChI

InChI=1S/C32H33FN6O/c1-31(2,3)21-39-25(16-23-18-35-28(17-34)36-29(23)39)20-38-27-7-5-4-6-26(27)32(30(38)40)12-14-37(15-13-32)19-22-8-10-24(33)11-9-22/h4-11,16,18H,12-15,19-21H2,1-3H3