2-methyl-N-[(Z)-1-methylsulfanyl-2-nitro-ethenyl]but-3-yn-2-amine

Systemtic Name: 2-methyl-N-[(Z)-1-methylsulfanyl-2-nitro-ethenyl]but-3-yn-2-amine Openeye Name: 2-methyl-N-[(Z)-1-methylsulfanyl-2-nitro-vinyl]but-3-yn-2-amine CAS Name: 2-methyl-N-[(Z)-1-(methylthio)-2-nitroethenyl]-3-butyn-2-amine IUPAC Name: 2-methyl-N-[(Z)-1-methylsulfanyl-2-nitroethenyl]but-3-yn-2-amine Traditional Name: 1,1-dimethylprop-2-ynyl-[(Z)-1-(methylthio)-2-nitro-vinyl]amine Formula: C8H12N2O2S MolecularWeight: 200.25808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#C)NC(=C[N+](=O)[O-])SC

Isomeric SMILES

CC(C)(C#C)N/C(=C/[N+](=O)[O-])/SC

InChI

InChI=1S/C8H12N2O2S/c1-5-8(2,3)9-7(13-4)6-10(11)12/h1,6,9H,2-4H3/b7-6-