N-[(E)-1-methylsulfanyl-2-nitro-ethenyl]prop-2-yn-1-amine

Systemtic Name: N-[(E)-1-methylsulfanyl-2-nitro-ethenyl]prop-2-yn-1-amine Openeye Name: N-[(E)-1-methylsulfanyl-2-nitro-vinyl]prop-2-yn-1-amine CAS Name: N-[(E)-1-(methylthio)-2-nitroethenyl]-2-propyn-1-amine IUPAC Name: N-[(E)-1-methylsulfanyl-2-nitroethenyl]prop-2-yn-1-amine Traditional Name: [(E)-1-(methylthio)-2-nitro-vinyl]-propargyl-amine Formula: C6H8N2O2S MolecularWeight: 172.20492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC(=C[N+](=O)[O-])NCC#C

Isomeric SMILES

CS/C(=C/[N+](=O)[O-])/NCC#C

InChI

InChI=1S/C6H8N2O2S/c1-3-4-7-6(11-2)5-8(9)10/h1,5,7H,4H2,2H3/b6-5+