4-[5-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-4-ethyl-1,2,4-triazol-3-yl]pyridine

Systemtic Name: 4-[5-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-4-ethyl-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-[5-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-4-ethyl-1,2,4-triazol-3-yl]pyridine CAS Name: 4-[5-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-4-ethyl-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-[5-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-4-ethyl-1,2,4-triazol-3-yl]pyridine Traditional Name: 4-[5-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-4-ethyl-1,2,4-triazol-3-yl]pyridine Formula: C18H17BrN4O2S MolecularWeight: 433.32218

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC3=C(C=C2Br)OCCO3)C4=CC=NC=C4

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC3=C(C=C2Br)OCCO3)C4=CC=NC=C4

InChI

InChI=1S/C18H17BrN4O2S/c1-2-23-17(12-3-5-20-6-4-12)21-22-18(23)26-11-13-9-15-16(10-14(13)19)25-8-7-24-15/h3-6,9-10H,2,7-8,11H2,1H3