N-tert-butyl-2-[(4-butyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(phenylmethyl)ethanamide

Systemtic Name: N-tert-butyl-2-[(4-butyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-N-tert-butyl-2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-tert-butyl-2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)thio]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-N-tert-butyl-2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-benzyl-N-tert-butyl-2-[(4-butyl-5-keto-1H-1,2,4-triazol-3-yl)thio]acetamide Formula: C19H28N4O2S MolecularWeight: 376.51622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)NN=C1SCC(=O)N(CC2=CC=CC=C2)C(C)(C)C

Isomeric SMILES

CCCCN1C(=O)NN=C1SCC(=O)N(CC2=CC=CC=C2)C(C)(C)C

InChI

InChI=1S/C19H28N4O2S/c1-5-6-12-22-17(25)20-21-18(22)26-14-16(24)23(19(2,3)4)13-15-10-8-7-9-11-15/h7-11H,5-6,12-14H2,1-4H3,(H,20,25)