N-[3-methyl-1-oxidanylidene-1-(1-pyridin-4-ylethylamino)butan-2-yl]adamantane-1-carboxamide

Systemtic Name: N-[3-methyl-1-oxidanylidene-1-(1-pyridin-4-ylethylamino)butan-2-yl]adamantane-1-carboxamide Openeye Name: N-[2-methyl-1-[1-(4-pyridyl)ethylcarbamoyl]propyl]adamantane-1-carboxamide CAS Name: N-[3-methyl-1-oxo-1-(1-pyridin-4-ylethylamino)butan-2-yl]-1-adamantanecarboxamide IUPAC Name: N-[3-methyl-1-oxo-1-(1-pyridin-4-ylethylamino)butan-2-yl]adamantane-1-carboxamide Traditional Name: N-[2-methyl-1-[1-(4-pyridyl)ethylcarbamoyl]propyl]adamantane-1-carboxamide Formula: C23H33N3O2 MolecularWeight: 383.52702

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(C)C1=CC=NC=C1)NC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C)C(C(=O)NC(C)C1=CC=NC=C1)NC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C23H33N3O2/c1-14(2)20(21(27)25-15(3)19-4-6-24-7-5-19)26-22(28)23-11-16-8-17(12-23)10-18(9-16)13-23/h4-7,14-18,20H,8-13H2,1-3H3,(H,25,27)(H,26,28)