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

Systemtic Name: 2-[[5-[(4-chloranyl-3-methyl-phenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]-N-propyl-ethanamide Openeye Name: 2-[[5-[(4-chloro-3-methyl-phenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]-N-propyl-acetamide CAS Name: 2-[[5-[(4-chloro-3-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]thio]-N-propylacetamide IUPAC Name: 2-[[5-[(4-chloro-3-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]-N-propylacetamide Traditional Name: 2-[[5-[(4-chloro-3-methyl-phenoxy)methyl]-1H-1,2,4-triazol-3-yl]thio]-N-propyl-acetamide Formula: C15H19ClN4O2S MolecularWeight: 354.85496

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19ClN4O2S/c1-3-6-17-14(21)9-23-15-18-13(19-20-15)8-22-11-4-5-12(16)10(2)7-11/h4-5,7H,3,6,8-9H2,1-2H3,(H,17,21)(H,18,19,20)