N-(5-tert-butyl-2-oxidanyl-phenyl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide

Systemtic Name: N-(5-tert-butyl-2-oxidanyl-phenyl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Openeye Name: N-(5-tert-butyl-2-hydroxy-phenyl)-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-(5-tert-butyl-2-hydroxyphenyl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide IUPAC Name: N-(5-tert-butyl-2-hydroxyphenyl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Traditional Name: N-(5-tert-butyl-2-hydroxy-phenyl)-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C19H22N4O2S2 MolecularWeight: 402.53358

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)O)NC(=O)CCN2C(=NNC2=S)C3=CC=CS3

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)O)NC(=O)CCN2C(=NNC2=S)C3=CC=CS3

InChI

InChI=1S/C19H22N4O2S2/c1-19(2,3)12-6-7-14(24)13(11-12)20-16(25)8-9-23-17(21-22-18(23)26)15-5-4-10-27-15/h4-7,10-11,24H,8-9H2,1-3H3,(H,20,25)(H,22,26)