2-(4-tert-butylphenyl)sulfanyl-N-(5-oxidanylidene-1H-1,2,4-triazol-4-yl)ethanamide

Systemtic Name: 2-(4-tert-butylphenyl)sulfanyl-N-(5-oxidanylidene-1H-1,2,4-triazol-4-yl)ethanamide Openeye Name: 2-(4-tert-butylphenyl)sulfanyl-N-(5-oxo-1H-1,2,4-triazol-4-yl)acetamide CAS Name: 2-[(4-tert-butylphenyl)thio]-N-(5-oxo-1H-1,2,4-triazol-4-yl)acetamide IUPAC Name: 2-(4-tert-butylphenyl)sulfanyl-N-(5-oxo-1H-1,2,4-triazol-4-yl)acetamide Traditional Name: 2-[(4-tert-butylphenyl)thio]-N-(5-keto-1H-1,2,4-triazol-4-yl)acetamide Formula: C14H18N4O2S MolecularWeight: 306.38332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)SCC(=O)NN2C=NNC2=O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)SCC(=O)NN2C=NNC2=O

InChI

InChI=1S/C14H18N4O2S/c1-14(2,3)10-4-6-11(7-5-10)21-8-12(19)17-18-9-15-16-13(18)20/h4-7,9H,8H2,1-3H3,(H,16,20)(H,17,19)