(E)-N1-[2-[2-(5-azanyl-1,3,4-thiadiazol-2-yl)ethylsulfanyl]ethyl]-N1'-[2-[(3-chloranylpyridin-2-yl)methylsulfanyl]ethyl]-2-nitro-ethene-1,1-diamine

Systemtic Name: (E)-N1-[2-[2-(5-azanyl-1,3,4-thiadiazol-2-yl)ethylsulfanyl]ethyl]-N1'-[2-[(3-chloranylpyridin-2-yl)methylsulfanyl]ethyl]-2-nitro-ethene-1,1-diamine Openeye Name: (E)-N1-[2-[2-(5-amino-1,3,4-thiadiazol-2-yl)ethylsulfanyl]ethyl]-N1'-[2-[(3-chloro-2-pyridyl)methylsulfanyl]ethyl]-2-nitro-ethene-1,1-diamine CAS Name: (E)-N1-[2-[2-(5-amino-1,3,4-thiadiazol-2-yl)ethylthio]ethyl]-N1'-[2-[(3-chloro-2-pyridinyl)methylthio]ethyl]-2-nitroethene-1,1-diamine IUPAC Name: (E)-1-N-[2-[2-(5-amino-1,3,4-thiadiazol-2-yl)ethylsulfanyl]ethyl]-1-N'-[2-[(3-chloropyridin-2-yl)methylsulfanyl]ethyl]-2-nitroethene-1,1-diamine Traditional Name: 2-[2-(5-amino-1,3,4-thiadiazol-2-yl)ethylthio]ethyl-[(E)-1-[2-[(3-chloro-2-pyridyl)methylthio]ethylamino]-2-nitro-vinyl]amine Formula: C16H22ClN7O2S3 MolecularWeight: 476.03958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)CSCCNC(=C[N+](=O)[O-])NCCSCCC2=NN=C(S2)N)Cl

Isomeric SMILES

C1=CC(=C(N=C1)CSCCN/C(=C/[N+](=O)[O-])/NCCSCCC2=NN=C(S2)N)Cl

InChI

InChI=1S/C16H22ClN7O2S3/c17-12-2-1-4-19-13(12)11-28-9-6-21-14(10-24(25)26)20-5-8-27-7-3-15-22-23-16(18)29-15/h1-2,4,10,20-21H,3,5-9,11H2,(H2,18,23)/b14-10+