N-[2-(2,6-dimethylphenoxy)ethyl]-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]pyridine-3-carboxamide

Systemtic Name: N-[2-(2,6-dimethylphenoxy)ethyl]-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]pyridine-3-carboxamide Openeye Name: N-[2-(2,6-dimethylphenoxy)ethyl]-2-[(5-methylisoxazol-3-yl)methylsulfanyl]pyridine-3-carboxamide CAS Name: N-[2-(2,6-dimethylphenoxy)ethyl]-2-[(5-methyl-3-isoxazolyl)methylthio]-3-pyridinecarboxamide IUPAC Name: N-[2-(2,6-dimethylphenoxy)ethyl]-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]pyridine-3-carboxamide Traditional Name: N-[2-(2,6-dimethylphenoxy)ethyl]-2-[(5-methylisoxazol-3-yl)methylthio]nicotinamide Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCCNC(=O)C2=C(N=CC=C2)SCC3=NOC(=C3)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCCNC(=O)C2=C(N=CC=C2)SCC3=NOC(=C3)C

InChI

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