3-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-cyclopropyl-4-ethyl-1,2,4-triazole

Systemtic Name: 3-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-cyclopropyl-4-ethyl-1,2,4-triazole Openeye Name: 3-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-cyclopropyl-4-ethyl-1,2,4-triazole CAS Name: 3-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]-5-cyclopropyl-4-ethyl-1,2,4-triazole IUPAC Name: 3-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-cyclopropyl-4-ethyl-1,2,4-triazole Traditional Name: 3-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]-5-cyclopropyl-4-ethyl-1,2,4-triazole Formula: C16H18ClN3O2S MolecularWeight: 351.85102

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=C3C(=CC(=C2)Cl)COCO3)C4CC4

Isomeric SMILES

CCN1C(=NN=C1SCC2=C3C(=CC(=C2)Cl)COCO3)C4CC4

InChI

InChI=1S/C16H18ClN3O2S/c1-2-20-15(10-3-4-10)18-19-16(20)23-8-12-6-13(17)5-11-7-21-9-22-14(11)12/h5-6,10H,2-4,7-9H2,1H3