2-(4-chloranyl-3-methyl-phenoxy)-N-[3-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-4-yl]ethanamide

Systemtic Name: 2-(4-chloranyl-3-methyl-phenoxy)-N-[3-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-4-yl]ethanamide Openeye Name: N-(3-benzylsulfanyl-5-methyl-1,2,4-triazol-4-yl)-2-(4-chloro-3-methyl-phenoxy)acetamide CAS Name: 2-(4-chloro-3-methylphenoxy)-N-[3-methyl-5-(phenylmethylthio)-1,2,4-triazol-4-yl]acetamide IUPAC Name: N-(3-benzylsulfanyl-5-methyl-1,2,4-triazol-4-yl)-2-(4-chloro-3-methylphenoxy)acetamide Traditional Name: N-[3-(benzylthio)-5-methyl-1,2,4-triazol-4-yl]-2-(4-chloro-3-methyl-phenoxy)acetamide Formula: C19H19ClN4O2S MolecularWeight: 402.89776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)NN2C(=NN=C2SCC3=CC=CC=C3)C)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)NN2C(=NN=C2SCC3=CC=CC=C3)C)Cl

InChI

InChI=1S/C19H19ClN4O2S/c1-13-10-16(8-9-17(13)20)26-11-18(25)23-24-14(2)21-22-19(24)27-12-15-6-4-3-5-7-15/h3-10H,11-12H2,1-2H3,(H,23,25)