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

Systemtic Name: 2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(1-phenylethyl)ethanamide Openeye Name: 2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(1-phenylethyl)acetamide CAS Name: 2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)thio]-N-(1-phenylethyl)acetamide IUPAC Name: 2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(1-phenylethyl)acetamide Traditional Name: 2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)thio]-N-(1-phenylethyl)acetamide Formula: C16H22N4OS MolecularWeight: 318.43708

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)CSC2=NNC(=N2)C(C)(C)C

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)CSC2=NNC(=N2)C(C)(C)C

InChI

InChI=1S/C16H22N4OS/c1-11(12-8-6-5-7-9-12)17-13(21)10-22-15-18-14(19-20-15)16(2,3)4/h5-9,11H,10H2,1-4H3,(H,17,21)(H,18,19,20)