N-[2-(4-ethoxyphenoxy)ethyl]-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]pyridine-3-carboxamide

Systemtic Name: N-[2-(4-ethoxyphenoxy)ethyl]-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]pyridine-3-carboxamide Openeye Name: N-[2-(4-ethoxyphenoxy)ethyl]-2-[(5-methylisoxazol-3-yl)methylsulfanyl]pyridine-3-carboxamide CAS Name: N-[2-(4-ethoxyphenoxy)ethyl]-2-[(5-methyl-3-isoxazolyl)methylthio]-3-pyridinecarboxamide IUPAC Name: N-[2-(4-ethoxyphenoxy)ethyl]-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]pyridine-3-carboxamide Traditional Name: N-[2-(4-ethoxyphenoxy)ethyl]-2-[(5-methylisoxazol-3-yl)methylthio]nicotinamide Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OCCNC(=O)C2=C(N=CC=C2)SCC3=NOC(=C3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)OCCNC(=O)C2=C(N=CC=C2)SCC3=NOC(=C3)C

InChI

InChI=1S/C21H23N3O4S/c1-3-26-17-6-8-18(9-7-17)27-12-11-22-20(25)19-5-4-10-23-21(19)29-14-16-13-15(2)28-24-16/h4-10,13H,3,11-12,14H2,1-2H3,(H,22,25)