3-(4-chlorophenyl)-4-(3-methoxypropyl)-5-[(4-nitro-8,10-dioxabicyclo[4.4.0]deca-2,4,11-trien-2-yl)methylsulfanyl]-1,2,4-triazole

Molecular Formula: C21H21ClN4O5S


InChI: InChI=1/C21H21ClN4O5S/c1-29-8-2-7-25-20(14-3-5-17(22)6-4-14)23-24-21(25)32-12-16-10-18(26(27)28)9-15-11-30-13-31-19(15)16/h3-6,9-10H,2,7-8,11-13H2,1H3

InChIKey: InChIKey=NRVQCLRCNRBUHR-UHFFFAOYAL
SMILES: COCCCN1C(=NN=C1SCC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3)C4=CC=C(C=C4)Cl

Names:
    3-(4-chlorophenyl)-4-(3-methoxypropyl)-5-[(4-nitro-8,10-dioxabicyclo[4.4.0]deca-2,4,11-trien-2-yl)methylsulfanyl]-1,2,4-triazole

Registries:
    PubChem CID 4457409
    PubChem ID 6570733