[2-(1-adamantyl)pyridin-4-yl]-(4-ethylpiperazin-1-yl)methanone

Systemtic Name: [2-(1-adamantyl)pyridin-4-yl]-(4-ethylpiperazin-1-yl)methanone Openeye Name: [2-(1-adamantyl)-4-pyridyl]-(4-ethylpiperazin-1-yl)methanone CAS Name: [2-(1-adamantyl)-4-pyridinyl]-(4-ethyl-1-piperazinyl)methanone IUPAC Name: [2-(1-adamantyl)pyridin-4-yl]-(4-ethylpiperazin-1-yl)methanone Traditional Name: [2-(1-adamantyl)-4-pyridyl]-(4-ethylpiperazino)methanone Formula: C22H31N3O MolecularWeight: 353.50104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)C2=CC(=NC=C2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCN1CCN(CC1)C(=O)C2=CC(=NC=C2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H31N3O/c1-2-24-5-7-25(8-6-24)21(26)19-3-4-23-20(12-19)22-13-16-9-17(14-22)11-18(10-16)15-22/h3-4,12,16-18H,2,5-11,13-15H2,1H3