(Z)-2-nitro-N1-pent-4-ynyl-N1'-[2-(pyridin-2-ylmethylsulfanyl)ethyl]ethene-1,1-diamine

Systemtic Name: (Z)-2-nitro-N1-pent-4-ynyl-N1'-[2-(pyridin-2-ylmethylsulfanyl)ethyl]ethene-1,1-diamine Openeye Name: (Z)-2-nitro-N1-pent-4-ynyl-N1'-[2-(2-pyridylmethylsulfanyl)ethyl]ethene-1,1-diamine CAS Name: (Z)-2-nitro-N1-pent-4-ynyl-N1'-[2-(2-pyridinylmethylthio)ethyl]ethene-1,1-diamine IUPAC Name: (Z)-2-nitro-1-N-pent-4-ynyl-1-N'-[2-(pyridin-2-ylmethylsulfanyl)ethyl]ethene-1,1-diamine Traditional Name: [(Z)-2-nitro-1-(pent-4-ynylamino)vinyl]-[2-(2-pyridylmethylthio)ethyl]amine Formula: C15H20N4O2S MolecularWeight: 320.4099

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Descriptors Computed from Structure

Canonical SMILES:

C#CCCCNC(=C[N+](=O)[O-])NCCSCC1=CC=CC=N1

Isomeric SMILES

C#CCCCN/C(=C/[N+](=O)[O-])/NCCSCC1=CC=CC=N1

InChI

InChI=1S/C15H20N4O2S/c1-2-3-5-9-17-15(12-19(20)21)18-10-11-22-13-14-7-4-6-8-16-14/h1,4,6-8,12,17-18H,3,5,9-11,13H2/b15-12-