4-tert-butyl-N-[2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]benzamide

Systemtic Name: 4-tert-butyl-N-[2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]benzamide Openeye Name: 4-tert-butyl-N-[2-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetyl]benzamide CAS Name: 4-tert-butyl-N-[1-oxo-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)thio]ethyl]benzamide IUPAC Name: 4-tert-butyl-N-[2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]benzamide Traditional Name: 4-tert-butyl-N-[2-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]thio]acetyl]benzamide Formula: C19H20N4O2S2 MolecularWeight: 400.5177

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=O)CSC2=NNC(=N2)C3=CC=CS3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=O)CSC2=NNC(=N2)C3=CC=CS3

InChI

InChI=1S/C19H20N4O2S2/c1-19(2,3)13-8-6-12(7-9-13)17(25)20-15(24)11-27-18-21-16(22-23-18)14-5-4-10-26-14/h4-10H,11H2,1-3H3,(H,20,24,25)(H,21,22,23)