4-[5-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]pyridine

Systemtic Name: 4-[5-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-[5-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]pyridine CAS Name: 4-[5-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]-4-methyl-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-[5-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]pyridine Traditional Name: 4-[5-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]-4-methyl-1,2,4-triazol-3-yl]pyridine Formula: C17H15ClN4O2S MolecularWeight: 374.8446

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=C3C(=CC(=C2)Cl)COCO3)C4=CC=NC=C4

Isomeric SMILES

CN1C(=NN=C1SCC2=C3C(=CC(=C2)Cl)COCO3)C4=CC=NC=C4

InChI

InChI=1S/C17H15ClN4O2S/c1-22-16(11-2-4-19-5-3-11)20-21-17(22)25-9-13-7-14(18)6-12-8-23-10-24-15(12)13/h2-7H,8-10H2,1H3