(E)-N1'-[2-[(4-bromanyl-3-methyl-1,2-thiazol-5-yl)methylsulfanyl]ethyl]-N1-[2-[(3-chloranylpyridin-2-yl)methylsulfanyl]ethyl]-2-nitro-ethene-1,1-diamine

Systemtic Name: (E)-N1'-[2-[(4-bromanyl-3-methyl-1,2-thiazol-5-yl)methylsulfanyl]ethyl]-N1-[2-[(3-chloranylpyridin-2-yl)methylsulfanyl]ethyl]-2-nitro-ethene-1,1-diamine Openeye Name: (E)-N1'-[2-[(4-bromo-3-methyl-isothiazol-5-yl)methylsulfanyl]ethyl]-N1-[2-[(3-chloro-2-pyridyl)methylsulfanyl]ethyl]-2-nitro-ethene-1,1-diamine CAS Name: (E)-N1'-[2-[(4-bromo-3-methyl-5-isothiazolyl)methylthio]ethyl]-N1-[2-[(3-chloro-2-pyridinyl)methylthio]ethyl]-2-nitroethene-1,1-diamine IUPAC Name: (E)-1-N'-[2-[(4-bromo-3-methyl-1,2-thiazol-5-yl)methylsulfanyl]ethyl]-1-N-[2-[(3-chloropyridin-2-yl)methylsulfanyl]ethyl]-2-nitroethene-1,1-diamine Traditional Name: 2-[(4-bromo-3-methyl-isothiazol-5-yl)methylthio]ethyl-[(E)-1-[2-[(3-chloro-2-pyridyl)methylthio]ethylamino]-2-nitro-vinyl]amine Formula: C17H21BrClN5O2S3 MolecularWeight: 538.93294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NSC(=C1Br)CSCCNC(=C[N+](=O)[O-])NCCSCC2=C(C=CC=N2)Cl

Isomeric SMILES

CC1=NSC(=C1Br)CSCCN/C(=C/[N+](=O)[O-])/NCCSCC2=C(C=CC=N2)Cl

InChI

InChI=1S/C17H21BrClN5O2S3/c1-12-17(18)15(29-23-12)11-28-8-6-22-16(9-24(25)26)21-5-7-27-10-14-13(19)3-2-4-20-14/h2-4,9,21-22H,5-8,10-11H2,1H3/b16-9+