N-[2-[2-(1-adamantyl)ethyl-(3-pyridin-4-ylpropylcarbamoyl)amino]ethyl]-N-methyl-ethanamide

Systemtic Name: N-[2-[2-(1-adamantyl)ethyl-(3-pyridin-4-ylpropylcarbamoyl)amino]ethyl]-N-methyl-ethanamide Openeye Name: N-[2-[2-(1-adamantyl)ethyl-[3-(4-pyridyl)propylcarbamoyl]amino]ethyl]-N-methyl-acetamide CAS Name: N-[2-[2-(1-adamantyl)ethyl-[oxo-(3-pyridin-4-ylpropylamino)methyl]amino]ethyl]-N-methylacetamide IUPAC Name: N-[2-[2-(1-adamantyl)ethyl-(3-pyridin-4-ylpropylcarbamoyl)amino]ethyl]-N-methylacetamide Traditional Name: N-[2-[2-(1-adamantyl)ethyl-[3-(4-pyridyl)propylcarbamoyl]amino]ethyl]-N-methyl-acetamide Formula: C26H40N4O2 MolecularWeight: 440.6214

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C)CCN(CCC12CC3CC(C1)CC(C3)C2)C(=O)NCCCC4=CC=NC=C4

Isomeric SMILES

CC(=O)N(C)CCN(CCC12CC3CC(C1)CC(C3)C2)C(=O)NCCCC4=CC=NC=C4

InChI

InChI=1S/C26H40N4O2/c1-20(31)29(2)12-13-30(25(32)28-8-3-4-21-5-9-27-10-6-21)11-7-26-17-22-14-23(18-26)16-24(15-22)19-26/h5-6,9-10,22-24H,3-4,7-8,11-19H2,1-2H3,(H,28,32)