NSC379877

Molecular Formula: C16H21Cl2N3O2S


InChI: InChI=1/C16H20ClN3O2S.ClH/c17-14-3-12-6-21-10-22-15(12)13(4-14)7-23-16-18-8-20(9-19-16)5-11-1-2-11;/h3-4,11H,1-2,5-10H2,(H,18,19);1H/fC16H21ClN3O2S.Cl/h18,20H;1h/q+1;-1

InChIKey: InChIKey=BWGCNVRTSHZLEA-HCMVHNFBCT
SMILES: C1CC1C[NH+]2CNC(=NC2)SCC3=C4C(=CC(=C3)Cl)COCO4.[Cl-]

Names:
    NSC379877
    2-[(4-chloro-8,10-dioxabicyclo[4.4.0]deca-2,4,11-trien-2-yl)methylsulfanyl]-5-(cyclopropylmethyl)-1,3-diaza-5-azoniacyclohexene chloride

Registries:
    PubChem CID 5458913
    PubChem ID 8141601