N-tert-butyl-2-[[4-methyl-5-[oxidanyl(phenyl)methyl]-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-tert-butyl-2-[[4-methyl-5-[oxidanyl(phenyl)methyl]-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-tert-butyl-2-[[5-[hydroxy(phenyl)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-tert-butyl-2-[[5-[hydroxy(phenyl)methyl]-4-methyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-tert-butyl-2-[[5-[hydroxy(phenyl)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-tert-butyl-2-[[5-[hydroxy(phenyl)methyl]-4-methyl-1,2,4-triazol-3-yl]thio]acetamide Formula: C16H22N4O2S MolecularWeight: 334.43648

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CSC1=NN=C(N1C)C(C2=CC=CC=C2)O

Isomeric SMILES

CC(C)(C)NC(=O)CSC1=NN=C(N1C)C(C2=CC=CC=C2)O

InChI

InChI=1S/C16H22N4O2S/c1-16(2,3)17-12(21)10-23-15-19-18-14(20(15)4)13(22)11-8-6-5-7-9-11/h5-9,13,22H,10H2,1-4H3,(H,17,21)