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

Systemtic Name: 4-azanyl-N-[(4-chlorophenyl)-cyclopropyl-methyl]-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide Openeye Name: 4-amino-N-[(4-chlorophenyl)-cyclopropyl-methyl]-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide CAS Name: 4-amino-N-[(4-chlorophenyl)-cyclopropylmethyl]-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-4-piperidinecarboxamide IUPAC Name: 4-amino-N-[(4-chlorophenyl)-cyclopropylmethyl]-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide Traditional Name: 4-amino-N-[(4-chlorophenyl)-cyclopropyl-methyl]-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)isonipecotamide Formula: C22H25ClN6O MolecularWeight: 424.9265

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(C2=CC=C(C=C2)Cl)NC(=O)C3(CCN(CC3)C4=NC=NC5=C4C=CN5)N

Isomeric SMILES

C1CC1C(C2=CC=C(C=C2)Cl)NC(=O)C3(CCN(CC3)C4=NC=NC5=C4C=CN5)N

InChI

InChI=1S/C22H25ClN6O/c23-16-5-3-15(4-6-16)18(14-1-2-14)28-21(30)22(24)8-11-29(12-9-22)20-17-7-10-25-19(17)26-13-27-20/h3-7,10,13-14,18H,1-2,8-9,11-12,24H2,(H,28,30)(H,25,26,27)