5-hex-1-ynyl-N-[1-(3-methoxy-3-methyl-butyl)pyrazol-4-yl]pyridine-3-carboxamide

Systemtic Name: 5-hex-1-ynyl-N-[1-(3-methoxy-3-methyl-butyl)pyrazol-4-yl]pyridine-3-carboxamide Openeye Name: 5-hex-1-ynyl-N-[1-(3-methoxy-3-methyl-butyl)pyrazol-4-yl]pyridine-3-carboxamide CAS Name: 5-hex-1-ynyl-N-[1-(3-methoxy-3-methylbutyl)-4-pyrazolyl]-3-pyridinecarboxamide IUPAC Name: 5-hex-1-ynyl-N-[1-(3-methoxy-3-methylbutyl)pyrazol-4-yl]pyridine-3-carboxamide Traditional Name: 5-hex-1-ynyl-N-[1-(3-methoxy-3-methyl-butyl)pyrazol-4-yl]nicotinamide Formula: C21H28N4O2 MolecularWeight: 368.47262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1=CC(=CN=C1)C(=O)NC2=CN(N=C2)CCC(C)(C)OC

Isomeric SMILES

CCCCC#CC1=CC(=CN=C1)C(=O)NC2=CN(N=C2)CCC(C)(C)OC

InChI

InChI=1S/C21H28N4O2/c1-5-6-7-8-9-17-12-18(14-22-13-17)20(26)24-19-15-23-25(16-19)11-10-21(2,3)27-4/h12-16H,5-7,10-11H2,1-4H3,(H,24,26)