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

Systemtic Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-phenethyl-pyridine-3-carboxamide Openeye Name: 2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]-N-phenethyl-pyridine-3-carboxamide CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-N-phenethyl-3-pyridinecarboxamide IUPAC Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-phenethylpyridine-3-carboxamide Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)methylthio]-N-phenethyl-nicotinamide Formula: C20H21N3O2S MolecularWeight: 367.46464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSC2=C(C=CC=N2)C(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NO1)C)CSC2=C(C=CC=N2)C(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C20H21N3O2S/c1-14-18(15(2)25-23-14)13-26-20-17(9-6-11-22-20)19(24)21-12-10-16-7-4-3-5-8-16/h3-9,11H,10,12-13H2,1-2H3,(H,21,24)