3,3-dimethyl-N-[5-[(2-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]butanamide

Systemtic Name: 3,3-dimethyl-N-[5-[(2-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]butanamide Openeye Name: 3,3-dimethyl-N-[5-(o-tolylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]butanamide CAS Name: 3,3-dimethyl-N-[5-[(2-methylphenyl)methylthio]-1,3,4-thiadiazol-2-yl]butanamide IUPAC Name: 3,3-dimethyl-N-[5-[(2-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]butanamide Traditional Name: 3,3-dimethyl-N-[5-[(2-methylbenzyl)thio]-1,3,4-thiadiazol-2-yl]butyramide Formula: C16H21N3OS2 MolecularWeight: 335.48744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N3OS2/c1-11-7-5-6-8-12(11)10-21-15-19-18-14(22-15)17-13(20)9-16(2,3)4/h5-8H,9-10H2,1-4H3,(H,17,18,20)