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

Systemtic Name: 2-[[5-[(4-chloranyl-3-methyl-phenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]-N-pentyl-ethanamide Openeye Name: 2-[[5-[(4-chloro-3-methyl-phenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]-N-pentyl-acetamide CAS Name: 2-[[5-[(4-chloro-3-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]thio]-N-pentylacetamide IUPAC Name: 2-[[5-[(4-chloro-3-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]-N-pentylacetamide Traditional Name: N-amyl-2-[[5-[(4-chloro-3-methyl-phenoxy)methyl]-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C17H23ClN4O2S MolecularWeight: 382.90812

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)CSC1=NNC(=N1)COC2=CC(=C(C=C2)Cl)C

Isomeric SMILES

CCCCCNC(=O)CSC1=NNC(=N1)COC2=CC(=C(C=C2)Cl)C

InChI

InChI=1S/C17H23ClN4O2S/c1-3-4-5-8-19-16(23)11-25-17-20-15(21-22-17)10-24-13-6-7-14(18)12(2)9-13/h6-7,9H,3-5,8,10-11H2,1-2H3,(H,19,23)(H,20,21,22)