(2R)-2-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-1-piperazin-1-yl-2-pyridin-4-yl-ethanone

Systemtic Name: (2R)-2-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-1-piperazin-1-yl-2-pyridin-4-yl-ethanone Openeye Name: (2R)-2-[(3S,5S)-3,5-dimethyl-1-piperidyl]-1-piperazin-1-yl-2-(4-pyridyl)ethanone CAS Name: (2R)-2-[(3S,5S)-3,5-dimethyl-1-piperidinyl]-1-(1-piperazinyl)-2-pyridin-4-ylethanone IUPAC Name: (2R)-2-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-1-piperazin-1-yl-2-pyridin-4-ylethanone Traditional Name: (2R)-2-[(3S,5S)-3,5-dimethylpiperidino]-1-piperazino-2-(4-pyridyl)ethanone Formula: C18H28N4O MolecularWeight: 316.44112

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(C2=CC=NC=C2)C(=O)N3CCNCC3)C

Isomeric SMILES

C[C@H]1C[C@@H](CN(C1)[C@H](C2=CC=NC=C2)C(=O)N3CCNCC3)C

InChI

InChI=1S/C18H28N4O/c1-14-11-15(2)13-22(12-14)17(16-3-5-19-6-4-16)18(23)21-9-7-20-8-10-21/h3-6,14-15,17,20H,7-13H2,1-2H3/t14-,15-,17+/m0/s1