1-[[5-[(4-ethylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]-3,3-dimethyl-butan-2-one

Systemtic Name: 1-[[5-[(4-ethylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]-3,3-dimethyl-butan-2-one Openeye Name: 1-[[5-(4-ethylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]-3,3-dimethyl-butan-2-one CAS Name: 1-[[5-(4-ethylanilino)-1,3,4-thiadiazol-2-yl]thio]-3,3-dimethyl-2-butanone IUPAC Name: 1-[[5-(4-ethylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]-3,3-dimethylbutan-2-one Traditional Name: 1-[[5-(4-ethylanilino)-1,3,4-thiadiazol-2-yl]thio]-3,3-dimethyl-butan-2-one Formula: C16H21N3OS2 MolecularWeight: 335.48744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC2=NN=C(S2)SCC(=O)C(C)(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC2=NN=C(S2)SCC(=O)C(C)(C)C

InChI

InChI=1S/C16H21N3OS2/c1-5-11-6-8-12(9-7-11)17-14-18-19-15(22-14)21-10-13(20)16(2,3)4/h6-9H,5,10H2,1-4H3,(H,17,18)