N-[5-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]ethanamide

Systemtic Name: N-[5-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]ethanamide Openeye Name: N-[5-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]acetamide CAS Name: N-[5-[(4-tert-butyl-2,6-dimethylphenyl)methylthio]-1,3,4-thiadiazol-2-yl]acetamide IUPAC Name: N-[5-[(4-tert-butyl-2,6-dimethylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]acetamide Traditional Name: N-[5-[(4-tert-butyl-2,6-dimethyl-benzyl)thio]-1,3,4-thiadiazol-2-yl]acetamide Formula: C17H23N3OS2 MolecularWeight: 349.51402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1CSC2=NN=C(S2)NC(=O)C)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1CSC2=NN=C(S2)NC(=O)C)C)C(C)(C)C

InChI

InChI=1S/C17H23N3OS2/c1-10-7-13(17(4,5)6)8-11(2)14(10)9-22-16-20-19-15(23-16)18-12(3)21/h7-8H,9H2,1-6H3,(H,18,19,21)