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

Systemtic Name: N-[3-methyl-1-oxidanylidene-1-(pyridin-4-ylmethylamino)butan-2-yl]adamantane-1-carboxamide Openeye Name: N-[2-methyl-1-(4-pyridylmethylcarbamoyl)propyl]adamantane-1-carboxamide CAS Name: N-[3-methyl-1-oxo-1-(pyridin-4-ylmethylamino)butan-2-yl]-1-adamantanecarboxamide IUPAC Name: N-[3-methyl-1-oxo-1-(pyridin-4-ylmethylamino)butan-2-yl]adamantane-1-carboxamide Traditional Name: N-[2-methyl-1-(4-pyridylmethylcarbamoyl)propyl]adamantane-1-carboxamide Formula: C22H31N3O2 MolecularWeight: 369.50044

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC1=CC=NC=C1)NC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C)C(C(=O)NCC1=CC=NC=C1)NC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H31N3O2/c1-14(2)19(20(26)24-13-15-3-5-23-6-4-15)25-21(27)22-10-16-7-17(11-22)9-18(8-16)12-22/h3-6,14,16-19H,7-13H2,1-2H3,(H,24,26)(H,25,27)