N-(4-acetamidophenyl)-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]pyridine-3-carboxamide

Systemtic Name: N-(4-acetamidophenyl)-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]pyridine-3-carboxamide Openeye Name: N-(4-acetamidophenyl)-2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]pyridine-3-carboxamide CAS Name: N-(4-acetamidophenyl)-2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-3-pyridinecarboxamide IUPAC Name: N-(4-acetamidophenyl)-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]pyridine-3-carboxamide Traditional Name: N-(4-acetamidophenyl)-2-[(3,5-dimethylisoxazol-4-yl)methylthio]nicotinamide Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSC2=C(C=CC=N2)C(=O)NC3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CC1=C(C(=NO1)C)CSC2=C(C=CC=N2)C(=O)NC3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C20H20N4O3S/c1-12-18(13(2)27-24-12)11-28-20-17(5-4-10-21-20)19(26)23-16-8-6-15(7-9-16)22-14(3)25/h4-10H,11H2,1-3H3,(H,22,25)(H,23,26)