4-azanyl-N-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-N-(quinolin-3-ylmethyl)piperidine-4-carboxamide

Systemtic Name: 4-azanyl-N-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-N-(quinolin-3-ylmethyl)piperidine-4-carboxamide Openeye Name: 4-amino-N-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-N-(3-quinolylmethyl)piperidine-4-carboxamide CAS Name: 4-amino-N-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-N-(3-quinolinylmethyl)-4-piperidinecarboxamide IUPAC Name: 4-amino-N-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-N-(quinolin-3-ylmethyl)piperidine-4-carboxamide Traditional Name: 4-amino-N-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-N-(3-quinolylmethyl)isonipecotamide Formula: C22H23N7O MolecularWeight: 401.46432

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1(C(=O)N(CC2=CC3=CC=CC=C3N=C2)C4=NC=NC5=C4C=CN5)N

Isomeric SMILES

C1CNCCC1(C(=O)N(CC2=CC3=CC=CC=C3N=C2)C4=NC=NC5=C4C=CN5)N

InChI

InChI=1S/C22H23N7O/c23-22(6-9-24-10-7-22)21(30)29(20-17-5-8-25-19(17)27-14-28-20)13-15-11-16-3-1-2-4-18(16)26-12-15/h1-5,8,11-12,14,24H,6-7,9-10,13,23H2,(H,25,27,28)