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

Systemtic Name: N-(5-tert-butyl-2-oxidanyl-phenyl)-3-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide Openeye Name: N-(5-tert-butyl-2-hydroxy-phenyl)-3-[3-(p-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-(5-tert-butyl-2-hydroxyphenyl)-3-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide IUPAC Name: N-(5-tert-butyl-2-hydroxyphenyl)-3-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide Traditional Name: N-(5-tert-butyl-2-hydroxy-phenyl)-3-[3-(p-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NNC(=S)N2CCC(=O)NC3=C(C=CC(=C3)C(C)(C)C)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=NNC(=S)N2CCC(=O)NC3=C(C=CC(=C3)C(C)(C)C)O

InChI

InChI=1S/C22H26N4O2S/c1-14-5-7-15(8-6-14)20-24-25-21(29)26(20)12-11-19(28)23-17-13-16(22(2,3)4)9-10-18(17)27/h5-10,13,27H,11-12H2,1-4H3,(H,23,28)(H,25,29)