3-[(3,5-dimethylphenyl)methylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one

Systemtic Name: 3-[(3,5-dimethylphenyl)methylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one Openeye Name: 3-[(3,5-dimethylphenyl)methylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one CAS Name: 3-[(3,5-dimethylphenyl)methylthio]-4-propyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-[(3,5-dimethylphenyl)methylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one Traditional Name: 3-[(3,5-dimethylbenzyl)thio]-4-propyl-1H-1,2,4-triazol-5-one Formula: C14H19N3OS MolecularWeight: 277.38516

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NN=C1SCC2=CC(=CC(=C2)C)C

Isomeric SMILES

CCCN1C(=O)NN=C1SCC2=CC(=CC(=C2)C)C

InChI

InChI=1S/C14H19N3OS/c1-4-5-17-13(18)15-16-14(17)19-9-12-7-10(2)6-11(3)8-12/h6-8H,4-5,9H2,1-3H3,(H,15,18)