N-[3-[(1-methylpyrazol-3-yl)carbonylamino]-1-adamantyl]pyridine-2-carboxamide

Systemtic Name: N-[3-[(1-methylpyrazol-3-yl)carbonylamino]-1-adamantyl]pyridine-2-carboxamide Openeye Name: N-[3-[(1-methylpyrazole-3-carbonyl)amino]-1-adamantyl]pyridine-2-carboxamide CAS Name: N-[3-[[(1-methyl-3-pyrazolyl)-oxomethyl]amino]-1-adamantyl]-2-pyridinecarboxamide IUPAC Name: N-[3-[(1-methylpyrazole-3-carbonyl)amino]-1-adamantyl]pyridine-2-carboxamide Traditional Name: N-[3-[(1-methylpyrazole-3-carbonyl)amino]-1-adamantyl]picolinamide Formula: C21H25N5O2 MolecularWeight: 379.4555

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)C(=O)NC23CC4CC(C2)CC(C4)(C3)NC(=O)C5=CC=CC=N5

Isomeric SMILES

CN1C=CC(=N1)C(=O)NC23CC4CC(C2)CC(C4)(C3)NC(=O)C5=CC=CC=N5

InChI

InChI=1S/C21H25N5O2/c1-26-7-5-17(25-26)19(28)24-21-11-14-8-15(12-21)10-20(9-14,13-21)23-18(27)16-4-2-3-6-22-16/h2-7,14-15H,8-13H2,1H3,(H,23,27)(H,24,28)