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

Systemtic Name: 4-(1-adamantyl)-N-[3-methyl-1-oxidanylidene-1-(pyridin-3-ylmethylamino)butan-2-yl]benzamide Openeye Name: 4-(1-adamantyl)-N-[2-methyl-1-(3-pyridylmethylcarbamoyl)propyl]benzamide CAS Name: 4-(1-adamantyl)-N-[3-methyl-1-oxo-1-(3-pyridinylmethylamino)butan-2-yl]benzamide IUPAC Name: 4-(1-adamantyl)-N-[3-methyl-1-oxo-1-(pyridin-3-ylmethylamino)butan-2-yl]benzamide Traditional Name: 4-(1-adamantyl)-N-[2-methyl-1-(3-pyridylmethylcarbamoyl)propyl]benzamide Formula: C28H35N3O2 MolecularWeight: 445.5964

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC1=CN=CC=C1)NC(=O)C2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(C)C(C(=O)NCC1=CN=CC=C1)NC(=O)C2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C28H35N3O2/c1-18(2)25(27(33)30-17-19-4-3-9-29-16-19)31-26(32)23-5-7-24(8-6-23)28-13-20-10-21(14-28)12-22(11-20)15-28/h3-9,16,18,20-22,25H,10-15,17H2,1-2H3,(H,30,33)(H,31,32)