2-[[5-(5-chloranyl-2-methoxy-phenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: 2-[[5-(5-chloranyl-2-methoxy-phenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[5-(5-chloro-2-methoxy-phenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: 2-[[5-(5-chloro-2-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: 2-[[5-(5-chloro-2-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: 2-[[5-(5-chloro-2-methoxy-phenyl)-4-methyl-1,2,4-triazol-3-yl]thio]acetamide Formula: C12H13ClN4O2S MolecularWeight: 312.77522

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)N)C2=C(C=CC(=C2)Cl)OC

Isomeric SMILES

CN1C(=NN=C1SCC(=O)N)C2=C(C=CC(=C2)Cl)OC

InChI

InChI=1S/C12H13ClN4O2S/c1-17-11(15-16-12(17)20-6-10(14)18)8-5-7(13)3-4-9(8)19-2/h3-5H,6H2,1-2H3,(H2,14,18)