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

Systemtic Name: N-(3-methoxyphenyl)-2-(4-methyl-5-phenacylsulfanyl-1,2,4-triazol-3-yl)ethanamide Openeye Name: N-(3-methoxyphenyl)-2-(4-methyl-5-phenacylsulfanyl-1,2,4-triazol-3-yl)acetamide CAS Name: N-(3-methoxyphenyl)-2-[4-methyl-5-(phenacylthio)-1,2,4-triazol-3-yl]acetamide IUPAC Name: N-(3-methoxyphenyl)-2-(4-methyl-5-phenacylsulfanyl-1,2,4-triazol-3-yl)acetamide Traditional Name: N-(3-methoxyphenyl)-2-[4-methyl-5-(phenacylthio)-1,2,4-triazol-3-yl]acetamide Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)C2=CC=CC=C2)CC(=O)NC3=CC(=CC=C3)OC

Isomeric SMILES

CN1C(=NN=C1SCC(=O)C2=CC=CC=C2)CC(=O)NC3=CC(=CC=C3)OC

InChI

InChI=1S/C20H20N4O3S/c1-24-18(12-19(26)21-15-9-6-10-16(11-15)27-2)22-23-20(24)28-13-17(25)14-7-4-3-5-8-14/h3-11H,12-13H2,1-2H3,(H,21,26)