N-[[2-(ethoxymethyl)phenyl]methyl]-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]pyridine-3-carboxamide

Systemtic Name: N-[[2-(ethoxymethyl)phenyl]methyl]-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]pyridine-3-carboxamide Openeye Name: N-[[2-(ethoxymethyl)phenyl]methyl]-2-[(5-methylisoxazol-3-yl)methylsulfanyl]pyridine-3-carboxamide CAS Name: N-[[2-(ethoxymethyl)phenyl]methyl]-2-[(5-methyl-3-isoxazolyl)methylthio]-3-pyridinecarboxamide IUPAC Name: N-[[2-(ethoxymethyl)phenyl]methyl]-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]pyridine-3-carboxamide Traditional Name: N-[2-(ethoxymethyl)benzyl]-2-[(5-methylisoxazol-3-yl)methylthio]nicotinamide Formula: C21H23N3O3S MolecularWeight: 397.49062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCC1=CC=CC=C1CNC(=O)C2=C(N=CC=C2)SCC3=NOC(=C3)C

Isomeric SMILES

CCOCC1=CC=CC=C1CNC(=O)C2=C(N=CC=C2)SCC3=NOC(=C3)C

InChI

InChI=1S/C21H23N3O3S/c1-3-26-13-17-8-5-4-7-16(17)12-23-20(25)19-9-6-10-22-21(19)28-14-18-11-15(2)27-24-18/h4-11H,3,12-14H2,1-2H3,(H,23,25)