(NE)-N-[2-[(2-chloranyl-1,3-thiazol-5-yl)methyl-prop-2-ynyl-amino]ethylsulfanyl-[3-[(2-chloranyl-1,3-thiazol-4-yl)methyl-prop-2-ynyl-amino]propylsulfanyl]methylidene]nitramide

Systemtic Name: (NE)-N-[2-[(2-chloranyl-1,3-thiazol-5-yl)methyl-prop-2-ynyl-amino]ethylsulfanyl-[3-[(2-chloranyl-1,3-thiazol-4-yl)methyl-prop-2-ynyl-amino]propylsulfanyl]methylidene]nitramide Openeye Name: (NE)-N-[2-[(2-chlorothiazol-5-yl)methyl-prop-2-ynyl-amino]ethylsulfanyl-[3-[(2-chlorothiazol-4-yl)methyl-prop-2-ynyl-amino]propylsulfanyl]methylene]nitramide CAS Name: (NE)-N-[[2-[(2-chloro-5-thiazolyl)methyl-prop-2-ynylamino]ethylthio]-[3-[(2-chloro-4-thiazolyl)methyl-prop-2-ynylamino]propylthio]methylidene]nitramide IUPAC Name: (NE)-N-[2-[(2-chloro-1,3-thiazol-5-yl)methyl-prop-2-ynylamino]ethylsulfanyl-[3-[(2-chloro-1,3-thiazol-4-yl)methyl-prop-2-ynylamino]propylsulfanyl]methylidene]nitramide Traditional Name: (NE)-N-[[2-[(2-chlorothiazol-5-yl)methyl-propargyl-amino]ethylthio]-[3-[(2-chlorothiazol-4-yl)methyl-propargyl-amino]propylthio]methylene]nitramide Formula: C20H22Cl2N6O2S4 MolecularWeight: 577.59368

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN(CCCSC(=N[N+](=O)[O-])SCCN(CC#C)CC1=CN=C(S1)Cl)CC2=CSC(=N2)Cl

Isomeric SMILES

C#CCN(CCCS/C(=N\[N+](=O)[O-])/SCCN(CC#C)CC1=CN=C(S1)Cl)CC2=CSC(=N2)Cl

InChI

InChI=1S/C20H22Cl2N6O2S4/c1-3-6-26(13-16-15-33-19(22)24-16)8-5-10-31-20(25-28(29)30)32-11-9-27(7-4-2)14-17-12-23-18(21)34-17/h1-2,12,15H,5-11,13-14H2/b25-20+