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

Systemtic Name: 4-(1-adamantyl)-N-[3-methyl-1-oxidanylidene-1-(pyridin-2-ylamino)butan-2-yl]benzamide Openeye Name: 4-(1-adamantyl)-N-[2-methyl-1-(2-pyridylcarbamoyl)propyl]benzamide CAS Name: 4-(1-adamantyl)-N-[3-methyl-1-oxo-1-(2-pyridinylamino)butan-2-yl]benzamide IUPAC Name: 4-(1-adamantyl)-N-[3-methyl-1-oxo-1-(pyridin-2-ylamino)butan-2-yl]benzamide Traditional Name: 4-(1-adamantyl)-N-[2-methyl-1-(2-pyridylcarbamoyl)propyl]benzamide Formula: C27H33N3O2 MolecularWeight: 431.56982

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC=CC=N1)NC(=O)C2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(C)C(C(=O)NC1=CC=CC=N1)NC(=O)C2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C27H33N3O2/c1-17(2)24(26(32)29-23-5-3-4-10-28-23)30-25(31)21-6-8-22(9-7-21)27-14-18-11-19(15-27)13-20(12-18)16-27/h3-10,17-20,24H,11-16H2,1-2H3,(H,30,31)(H,28,29,32)