3-[2-(3-chloranylphenoxy)ethylsulfanyl]-4-cyclopropyl-1H-1,2,4-triazol-5-one

Systemtic Name: 3-[2-(3-chloranylphenoxy)ethylsulfanyl]-4-cyclopropyl-1H-1,2,4-triazol-5-one Openeye Name: 3-[2-(3-chlorophenoxy)ethylsulfanyl]-4-cyclopropyl-1H-1,2,4-triazol-5-one CAS Name: 3-[2-(3-chlorophenoxy)ethylthio]-4-cyclopropyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-[2-(3-chlorophenoxy)ethylsulfanyl]-4-cyclopropyl-1H-1,2,4-triazol-5-one Traditional Name: 3-[2-(3-chlorophenoxy)ethylthio]-4-cyclopropyl-1H-1,2,4-triazol-5-one Formula: C13H14ClN3O2S MolecularWeight: 311.78716

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=O)NN=C2SCCOC3=CC(=CC=C3)Cl

Isomeric SMILES

C1CC1N2C(=O)NN=C2SCCOC3=CC(=CC=C3)Cl

InChI

InChI=1S/C13H14ClN3O2S/c14-9-2-1-3-11(8-9)19-6-7-20-13-16-15-12(18)17(13)10-4-5-10/h1-3,8,10H,4-7H2,(H,15,18)