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

Systemtic Name: N-butyl-2-[[5-[(4-chloranyl-3-methyl-phenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]-N-ethyl-ethanamide Openeye Name: N-butyl-2-[[5-[(4-chloro-3-methyl-phenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]-N-ethyl-acetamide CAS Name: N-butyl-2-[[5-[(4-chloro-3-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]thio]-N-ethylacetamide IUPAC Name: N-butyl-2-[[5-[(4-chloro-3-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]-N-ethylacetamide Traditional Name: N-butyl-2-[[5-[(4-chloro-3-methyl-phenoxy)methyl]-1H-1,2,4-triazol-3-yl]thio]-N-ethyl-acetamide Formula: C18H25ClN4O2S MolecularWeight: 396.9347

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25ClN4O2S/c1-4-6-9-23(5-2)17(24)12-26-18-20-16(21-22-18)11-25-14-7-8-15(19)13(3)10-14/h7-8,10H,4-6,9,11-12H2,1-3H3,(H,20,21,22)