N-[[4-ethyl-5-[2-oxidanylidene-2-(phenethylamino)ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-2-methyl-benzamide

Systemtic Name: N-[[4-ethyl-5-[2-oxidanylidene-2-(phenethylamino)ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-2-methyl-benzamide Openeye Name: N-[[4-ethyl-5-[2-oxo-2-(phenethylamino)ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-2-methyl-benzamide CAS Name: N-[[4-ethyl-5-[[2-oxo-2-(phenethylamino)ethyl]thio]-1,2,4-triazol-3-yl]methyl]-2-methylbenzamide IUPAC Name: N-[[4-ethyl-5-[2-oxo-2-(phenethylamino)ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-2-methylbenzamide Traditional Name: N-[[4-ethyl-5-[[2-keto-2-(phenethylamino)ethyl]thio]-1,2,4-triazol-3-yl]methyl]-2-methyl-benzamide Formula: C23H27N5O2S MolecularWeight: 437.55778

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NCCC2=CC=CC=C2)CNC(=O)C3=CC=CC=C3C

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NCCC2=CC=CC=C2)CNC(=O)C3=CC=CC=C3C

InChI

InChI=1S/C23H27N5O2S/c1-3-28-20(15-25-22(30)19-12-8-7-9-17(19)2)26-27-23(28)31-16-21(29)24-14-13-18-10-5-4-6-11-18/h4-12H,3,13-16H2,1-2H3,(H,24,29)(H,25,30)