2-[[5-(tert-butylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(4-methylphenyl)propan-1-one

Systemtic Name: 2-[[5-(tert-butylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(4-methylphenyl)propan-1-one Openeye Name: 2-[[5-(tert-butylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(p-tolyl)propan-1-one CAS Name: 2-[[5-(tert-butylamino)-1,3,4-thiadiazol-2-yl]thio]-1-(4-methylphenyl)-1-propanone IUPAC Name: 2-[[5-(tert-butylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(4-methylphenyl)propan-1-one Traditional Name: 2-[[5-(tert-butylamino)-1,3,4-thiadiazol-2-yl]thio]-1-(p-tolyl)propan-1-one Formula: C16H21N3OS2 MolecularWeight: 335.48744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(C)SC2=NN=C(S2)NC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C(C)SC2=NN=C(S2)NC(C)(C)C

InChI

InChI=1S/C16H21N3OS2/c1-10-6-8-12(9-7-10)13(20)11(2)21-15-19-18-14(22-15)17-16(3,4)5/h6-9,11H,1-5H3,(H,17,18)