ethyl 4-[[7-(3-methylphenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-yl]amino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[7-(3-methylphenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-yl]amino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[7-(m-tolyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-yl]amino]piperidine-1-carboxylate CAS Name: 4-[[7-(3-methylphenyl)-5-phenyl-4-pyrrolo[2,3-d]pyrimidinyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[7-(3-methylphenyl)-5-phenylpyrrolo[2,3-d]pyrimidin-4-yl]amino]piperidine-1-carboxylate Traditional Name: 4-[[7-(m-tolyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-yl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C27H29N5O2 MolecularWeight: 455.55146

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC2=NC=NC3=C2C(=CN3C4=CC=CC(=C4)C)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC2=NC=NC3=C2C(=CN3C4=CC=CC(=C4)C)C5=CC=CC=C5

InChI

InChI=1S/C27H29N5O2/c1-3-34-27(33)31-14-12-21(13-15-31)30-25-24-23(20-9-5-4-6-10-20)17-32(26(24)29-18-28-25)22-11-7-8-19(2)16-22/h4-11,16-18,21H,3,12-15H2,1-2H3,(H,28,29,30)