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

Systemtic Name: ethyl 4-[[7-(4-methoxyphenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-yl]amino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[7-(4-methoxyphenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-yl]amino]piperidine-1-carboxylate CAS Name: 4-[[7-(4-methoxyphenyl)-5-phenyl-4-pyrrolo[2,3-d]pyrimidinyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[7-(4-methoxyphenyl)-5-phenylpyrrolo[2,3-d]pyrimidin-4-yl]amino]piperidine-1-carboxylate Traditional Name: 4-[[7-(4-methoxyphenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-yl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C27H29N5O3 MolecularWeight: 471.55086

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H29N5O3/c1-3-35-27(33)31-15-13-20(14-16-31)30-25-24-23(19-7-5-4-6-8-19)17-32(26(24)29-18-28-25)21-9-11-22(34-2)12-10-21/h4-12,17-18,20H,3,13-16H2,1-2H3,(H,28,29,30)