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

Systemtic Name: N-[1-(3-acetamidophenyl)ethyl]-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]pyridine-3-carboxamide Openeye Name: N-[1-(3-acetamidophenyl)ethyl]-2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]pyridine-3-carboxamide CAS Name: N-[1-(3-acetamidophenyl)ethyl]-2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-3-pyridinecarboxamide IUPAC Name: N-[1-(3-acetamidophenyl)ethyl]-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]pyridine-3-carboxamide Traditional Name: N-[1-(3-acetamidophenyl)ethyl]-2-[(3,5-dimethylisoxazol-4-yl)methylthio]nicotinamide Formula: C22H24N4O3S MolecularWeight: 424.51596

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N4O3S/c1-13(17-7-5-8-18(11-17)25-16(4)27)24-21(28)19-9-6-10-23-22(19)30-12-20-14(2)26-29-15(20)3/h5-11,13H,12H2,1-4H3,(H,24,28)(H,25,27)