3-[3-(2,5-dimethylphenoxy)propylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one

Systemtic Name: 3-[3-(2,5-dimethylphenoxy)propylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one Openeye Name: 3-[3-(2,5-dimethylphenoxy)propylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one CAS Name: 3-[3-(2,5-dimethylphenoxy)propylthio]-4-propyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-[3-(2,5-dimethylphenoxy)propylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one Traditional Name: 3-[3-(2,5-dimethylphenoxy)propylthio]-4-propyl-1H-1,2,4-triazol-5-one Formula: C16H23N3O2S MolecularWeight: 321.43772

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NN=C1SCCCOC2=C(C=CC(=C2)C)C

Isomeric SMILES

CCCN1C(=O)NN=C1SCCCOC2=C(C=CC(=C2)C)C

InChI

InChI=1S/C16H23N3O2S/c1-4-8-19-15(20)17-18-16(19)22-10-5-9-21-14-11-12(2)6-7-13(14)3/h6-7,11H,4-5,8-10H2,1-3H3,(H,17,20)