2-(4-methoxyphenyl)-N-[(4-methyl-5-phenacylsulfanyl-1,2,4-triazol-3-yl)methyl]ethanamide

Systemtic Name: 2-(4-methoxyphenyl)-N-[(4-methyl-5-phenacylsulfanyl-1,2,4-triazol-3-yl)methyl]ethanamide Openeye Name: 2-(4-methoxyphenyl)-N-[(4-methyl-5-phenacylsulfanyl-1,2,4-triazol-3-yl)methyl]acetamide CAS Name: 2-(4-methoxyphenyl)-N-[[4-methyl-5-(phenacylthio)-1,2,4-triazol-3-yl]methyl]acetamide IUPAC Name: 2-(4-methoxyphenyl)-N-[(4-methyl-5-phenacylsulfanyl-1,2,4-triazol-3-yl)methyl]acetamide Traditional Name: 2-(4-methoxyphenyl)-N-[[4-methyl-5-(phenacylthio)-1,2,4-triazol-3-yl]methyl]acetamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)C2=CC=CC=C2)CNC(=O)CC3=CC=C(C=C3)OC

Isomeric SMILES

CN1C(=NN=C1SCC(=O)C2=CC=CC=C2)CNC(=O)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C21H22N4O3S/c1-25-19(13-22-20(27)12-15-8-10-17(28-2)11-9-15)23-24-21(25)29-14-18(26)16-6-4-3-5-7-16/h3-11H,12-14H2,1-2H3,(H,22,27)