4-azanyl-N-(pyridin-4-ylmethyl)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide

Systemtic Name: 4-azanyl-N-(pyridin-4-ylmethyl)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide Openeye Name: 4-amino-N-(4-pyridylmethyl)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide CAS Name: 4-amino-N-(pyridin-4-ylmethyl)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-4-piperidinecarboxamide IUPAC Name: 4-amino-N-(pyridin-4-ylmethyl)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide Traditional Name: 4-amino-N-(4-pyridylmethyl)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)isonipecotamide Formula: C18H21N7O MolecularWeight: 351.40564

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C(=O)NCC2=CC=NC=C2)N)C3=NC=NC4=C3C=CN4

Isomeric SMILES

C1CN(CCC1(C(=O)NCC2=CC=NC=C2)N)C3=NC=NC4=C3C=CN4

InChI

InChI=1S/C18H21N7O/c19-18(17(26)22-11-13-1-6-20-7-2-13)4-9-25(10-5-18)16-14-3-8-21-15(14)23-12-24-16/h1-3,6-8,12H,4-5,9-11,19H2,(H,22,26)(H,21,23,24)