4-tert-butyl-N-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanoyl]benzamide

Systemtic Name: 4-tert-butyl-N-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanoyl]benzamide Openeye Name: 4-tert-butyl-N-[2-(1H-1,2,4-triazol-5-ylsulfanyl)acetyl]benzamide CAS Name: 4-tert-butyl-N-[1-oxo-2-(1H-1,2,4-triazol-5-ylthio)ethyl]benzamide IUPAC Name: 4-tert-butyl-N-[2-(1H-1,2,4-triazol-5-ylsulfanyl)acetyl]benzamide Traditional Name: 4-tert-butyl-N-[2-(1H-1,2,4-triazol-5-ylthio)acetyl]benzamide Formula: C15H18N4O2S MolecularWeight: 318.39402

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=O)CSC2=NC=NN2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=O)CSC2=NC=NN2

InChI

InChI=1S/C15H18N4O2S/c1-15(2,3)11-6-4-10(5-7-11)13(21)18-12(20)8-22-14-16-9-17-19-14/h4-7,9H,8H2,1-3H3,(H,16,17,19)(H,18,20,21)