N-[2-[[4-ethyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]-2-phenyl-ethanamide

Systemtic Name: N-[2-[[4-ethyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]-2-phenyl-ethanamide Openeye Name: N-[2-[[4-ethyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]-2-phenyl-acetamide CAS Name: N-[2-[[4-ethyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-1-oxoethyl]-2-phenylacetamide IUPAC Name: N-[2-[[4-ethyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]-2-phenylacetamide Traditional Name: N-[2-[[4-ethyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]thio]acetyl]-2-phenyl-acetamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC(=O)CC2=CC=CC=C2)C3=CC=C(C=C3)OC

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC(=O)CC2=CC=CC=C2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H22N4O3S/c1-3-25-20(16-9-11-17(28-2)12-10-16)23-24-21(25)29-14-19(27)22-18(26)13-15-7-5-4-6-8-15/h4-12H,3,13-14H2,1-2H3,(H,22,26,27)