登录 免费注册 发布信息
咨询热线：028-85335741
药品资讯网--新药研发行业门户!
您现在的位置：药品资讯网 > 专业资料首页 > 健康论文数据库 > N-[[4-(2-chlorophenyl)but-3-en-2-ylideneamino]-sulfanylmethylidene]-1

  • N-[[4-(2-chlorophenyl)but-3-en-2-ylideneamino]-sulfanylmethylidene]-1
  • 发布时间：2004-10-25 来源：本站整理
  • [Synonyms]

    [Structure]

    [ Properties Computed from Structure]
    Molecular Weight297.82678 [g/mol]
    Molecular FormulaC12H12ClN3S2
    XLogP3.4
    H-Bond Donor1
    H-Bond Acceptor3
    Rotatable Bond Count4
    Tautomer Count5
    Exact Mass297.016116
    MonoIsotopic Mass297.016116
    Topological Polar Surface Area48.6
    Heavy Atom Count18
    Formal Charge0
    Complexity391
    Isotope Atom Count0
    Defined Atom StereoCenter Count0
    Undefined Atom StereoCenter Count0
    Defined Bond StereoCenter Count0
    Undefined Bond StereoCenter Count3
    Covalently-Bonded Unit Count1

    [ Descriptors Computed from Structure]
    IUPAC Name: N-[[4-(2-chlorophenyl)but-3-en-2-ylideneamino]-sulfanylmethylidene]-1-
    sulfanylmethanimidamide
    Canonical SMILES: CC(=NC(=NC(=N)S)S)C=CC1=CC=CC=C1Cl
    InChI: InChI=1/C12H12ClN3S2/c1-8(15-12(18)16-11(14)17)6-7-9-4-2-3-5-10(9)13/h2-
    7H,1H3,(H3,14,16,17,18)/b7-6u,15-8+/f/h14,17-18H/b7-6u,14-11-,15-8+,
    16-12-

    ChemDrug版权识别码:848067211741072880
赞助商链接

健康论文数据库
推荐专业资料
赞助商链接