1-[4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-2-phenoxy-ethanone

Systemtic Name: 1-[4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-2-phenoxy-ethanone Openeye Name: 1-[4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-1-piperidyl]-2-phenoxy-ethanone CAS Name: 1-[4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-1-piperidinyl]-2-phenoxyethanone IUPAC Name: 1-[4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-2-phenoxyethanone Traditional Name: 1-[4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidino]-2-phenoxy-ethanone Formula: C21H25N5O2 MolecularWeight: 379.4555

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1N(C)C2=NC=NC3=C2C=CN3)C(=O)COC4=CC=CC=C4

Isomeric SMILES

CC1CCN(CC1N(C)C2=NC=NC3=C2C=CN3)C(=O)COC4=CC=CC=C4

InChI

InChI=1S/C21H25N5O2/c1-15-9-11-26(19(27)13-28-16-6-4-3-5-7-16)12-18(15)25(2)21-17-8-10-22-20(17)23-14-24-21/h3-8,10,14-15,18H,9,11-13H2,1-2H3,(H,22,23,24)