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

Systemtic Name: N-[[3-(ethylcarbamoyl)phenyl]methyl]-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]pyridine-3-carboxamide Openeye Name: N-[[3-(ethylcarbamoyl)phenyl]methyl]-2-[(5-methylisoxazol-3-yl)methylsulfanyl]pyridine-3-carboxamide CAS Name: N-[[3-(ethylcarbamoyl)phenyl]methyl]-2-[(5-methyl-3-isoxazolyl)methylthio]-3-pyridinecarboxamide IUPAC Name: N-[[3-(ethylcarbamoyl)phenyl]methyl]-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]pyridine-3-carboxamide Traditional Name: N-[3-(ethylcarbamoyl)benzyl]-2-[(5-methylisoxazol-3-yl)methylthio]nicotinamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC(=CC=C1)CNC(=O)C2=C(N=CC=C2)SCC3=NOC(=C3)C

Isomeric SMILES

CCNC(=O)C1=CC(=CC=C1)CNC(=O)C2=C(N=CC=C2)SCC3=NOC(=C3)C

InChI

InChI=1S/C21H22N4O3S/c1-3-22-19(26)16-7-4-6-15(11-16)12-24-20(27)18-8-5-9-23-21(18)29-13-17-10-14(2)28-25-17/h4-11H,3,12-13H2,1-2H3,(H,22,26)(H,24,27)