2-isocyanoethyl N-[(Z)-N-(2-cyanoethoxycarbonyl)-C-methylsulfanyl-carbonimidoyl]carbamate

Systemtic Name: 2-isocyanoethyl N-[(Z)-N-(2-cyanoethoxycarbonyl)-C-methylsulfanyl-carbonimidoyl]carbamate Openeye Name: 2-isocyanoethyl N-[(Z)-N-(2-cyanoethoxycarbonyl)-C-methylsulfanyl-carbonimidoyl]carbamate CAS Name: N-[(Z)-[2-cyanoethoxy(oxo)methyl]imino-(methylthio)methyl]carbamic acid 2-isocyanoethyl ester IUPAC Name: 2-isocyanoethyl N-[(Z)-N-(2-cyanoethoxycarbonyl)-C-methylsulfanylcarbonimidoyl]carbamate Traditional Name: N-[(Z)-N-(2-cyanoethoxycarbonyl)-C-(methylthio)carbonimidoyl]carbamic acid 2-isocyanoethyl ester Formula: C10H12N4O4S MolecularWeight: 284.29168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC(=NC(=O)OCCC#N)NC(=O)OCC[N+]#[C-]

Isomeric SMILES

CS/C(=N\C(=O)OCCC#N)/NC(=O)OCC[N+]#[C-]

InChI

InChI=1S/C10H12N4O4S/c1-12-5-7-18-10(16)14-8(19-2)13-9(15)17-6-3-4-11/h3,5-7H2,2H3,(H,13,14,15,16)