2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-(4-methyl-3-nitro-phenyl)ethanamide

Systemtic Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-(4-methyl-3-nitro-phenyl)ethanamide Openeye Name: 2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]-N-(4-methyl-3-nitro-phenyl)acetamide CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-N-(4-methyl-3-nitrophenyl)acetamide IUPAC Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-(4-methyl-3-nitrophenyl)acetamide Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)methylthio]-N-(4-methyl-3-nitro-phenyl)acetamide Formula: C15H17N3O4S MolecularWeight: 335.37818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSCC2=C(ON=C2C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSCC2=C(ON=C2C)C)[N+](=O)[O-]

InChI

InChI=1S/C15H17N3O4S/c1-9-4-5-12(6-14(9)18(20)21)16-15(19)8-23-7-13-10(2)17-22-11(13)3/h4-6H,7-8H2,1-3H3,(H,16,19)