[(3S)-3-[ethyl(pyridin-4-ylmethyl)amino]piperidin-1-yl]-(1-piperidin-1-ylcyclohexyl)methanone

Systemtic Name: [(3S)-3-[ethyl(pyridin-4-ylmethyl)amino]piperidin-1-yl]-(1-piperidin-1-ylcyclohexyl)methanone Openeye Name: [(3S)-3-[ethyl(4-pyridylmethyl)amino]-1-piperidyl]-[1-(1-piperidyl)cyclohexyl]methanone CAS Name: [(3S)-3-[ethyl(pyridin-4-ylmethyl)amino]-1-piperidinyl]-[1-(1-piperidinyl)cyclohexyl]methanone IUPAC Name: [(3S)-3-[ethyl(pyridin-4-ylmethyl)amino]piperidin-1-yl]-(1-piperidin-1-ylcyclohexyl)methanone Traditional Name: [(3S)-3-[ethyl(4-pyridylmethyl)amino]piperidino]-(1-piperidinocyclohexyl)methanone Formula: C25H40N4O MolecularWeight: 412.6113

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=NC=C1)C2CCCN(C2)C(=O)C3(CCCCC3)N4CCCCC4

Isomeric SMILES

CCN(CC1=CC=NC=C1)[C@H]2CCCN(C2)C(=O)C3(CCCCC3)N4CCCCC4

InChI

InChI=1S/C25H40N4O/c1-2-27(20-22-11-15-26-16-12-22)23-10-9-17-28(21-23)24(30)25(13-5-3-6-14-25)29-18-7-4-8-19-29/h11-12,15-16,23H,2-10,13-14,17-21H2,1H3/t23-/m0/s1