3-[(3,4-dichlorophenyl)methylsulfanyl]-4-(3-methoxypropyl)-1H-1,2,4-triazol-5-one

Systemtic Name: 3-[(3,4-dichlorophenyl)methylsulfanyl]-4-(3-methoxypropyl)-1H-1,2,4-triazol-5-one Openeye Name: 3-[(3,4-dichlorophenyl)methylsulfanyl]-4-(3-methoxypropyl)-1H-1,2,4-triazol-5-one CAS Name: 3-[(3,4-dichlorophenyl)methylthio]-4-(3-methoxypropyl)-1H-1,2,4-triazol-5-one IUPAC Name: 3-[(3,4-dichlorophenyl)methylsulfanyl]-4-(3-methoxypropyl)-1H-1,2,4-triazol-5-one Traditional Name: 3-[(3,4-dichlorobenzyl)thio]-4-(3-methoxypropyl)-1H-1,2,4-triazol-5-one Formula: C13H15Cl2N3O2S MolecularWeight: 348.2481

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)NN=C1SCC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

COCCCN1C(=O)NN=C1SCC2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C13H15Cl2N3O2S/c1-20-6-2-5-18-12(19)16-17-13(18)21-8-9-3-4-10(14)11(15)7-9/h3-4,7H,2,5-6,8H2,1H3,(H,16,19)