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

Systemtic Name: N-(5-tert-butyl-2-oxidanyl-phenyl)-3-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide Openeye Name: N-(5-tert-butyl-2-hydroxy-phenyl)-3-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-(5-tert-butyl-2-hydroxyphenyl)-3-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide IUPAC Name: N-(5-tert-butyl-2-hydroxyphenyl)-3-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide Traditional Name: N-(5-tert-butyl-2-hydroxy-phenyl)-3-[3-(m-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=CC(=C1)C2=NNC(=S)N2CCC(=O)NC3=C(C=CC(=C3)C(C)(C)C)O

Isomeric SMILES

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

InChI

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