2-(1-adamantyl)-N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]ethanamide

Systemtic Name: 2-(1-adamantyl)-N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]ethanamide Openeye Name: 2-(1-adamantyl)-N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]acetamide CAS Name: 2-(1-adamantyl)-N-[4-(4-ethyl-1-piperazinyl)-2-methylphenyl]acetamide IUPAC Name: 2-(1-adamantyl)-N-[4-(4-ethylpiperazin-1-yl)-2-methylphenyl]acetamide Traditional Name: 2-(1-adamantyl)-N-[4-(4-ethylpiperazino)-2-methyl-phenyl]acetamide Formula: C25H37N3O MolecularWeight: 395.58078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC(=C(C=C2)NC(=O)CC34CC5CC(C3)CC(C5)C4)C

Isomeric SMILES

CCN1CCN(CC1)C2=CC(=C(C=C2)NC(=O)CC34CC5CC(C3)CC(C5)C4)C

InChI

InChI=1S/C25H37N3O/c1-3-27-6-8-28(9-7-27)22-4-5-23(18(2)10-22)26-24(29)17-25-14-19-11-20(15-25)13-21(12-19)16-25/h4-5,10,19-21H,3,6-9,11-17H2,1-2H3,(H,26,29)