3-[(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-4-ethyl-5-phenyl-1,2,4-triazole

Systemtic Name: 3-[(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-4-ethyl-5-phenyl-1,2,4-triazole Openeye Name: 3-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-4-ethyl-5-phenyl-1,2,4-triazole CAS Name: 3-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-4-ethyl-5-phenyl-1,2,4-triazole IUPAC Name: 3-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-4-ethyl-5-phenyl-1,2,4-triazole Traditional Name: 3-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-4-ethyl-5-phenyl-1,2,4-triazole Formula: C19H18ClN3O2S MolecularWeight: 387.88312

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC3=C(C(=C2)Cl)OCCO3)C4=CC=CC=C4

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC3=C(C(=C2)Cl)OCCO3)C4=CC=CC=C4

InChI

InChI=1S/C19H18ClN3O2S/c1-2-23-18(14-6-4-3-5-7-14)21-22-19(23)26-12-13-10-15(20)17-16(11-13)24-8-9-25-17/h3-7,10-11H,2,8-9,12H2,1H3