1-[7-(4-chlorophenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-yl]piperidine-4-carboxamide

Systemtic Name: 1-[7-(4-chlorophenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-yl]piperidine-4-carboxamide Openeye Name: 1-[7-(4-chlorophenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-yl]piperidine-4-carboxamide CAS Name: 1-[7-(4-chlorophenyl)-5-phenyl-4-pyrrolo[2,3-d]pyrimidinyl]-4-piperidinecarboxamide IUPAC Name: 1-[7-(4-chlorophenyl)-5-phenylpyrrolo[2,3-d]pyrimidin-4-yl]piperidine-4-carboxamide Traditional Name: 1-[7-(4-chlorophenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-yl]isonipecotamide Formula: C24H22ClN5O MolecularWeight: 431.91738

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)C2=NC=NC3=C2C(=CN3C4=CC=C(C=C4)Cl)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C(=O)N)C2=NC=NC3=C2C(=CN3C4=CC=C(C=C4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C24H22ClN5O/c25-18-6-8-19(9-7-18)30-14-20(16-4-2-1-3-5-16)21-23(27-15-28-24(21)30)29-12-10-17(11-13-29)22(26)31/h1-9,14-15,17H,10-13H2,(H2,26,31)