(4-cyano-1-ethoxycarbothioylsulfanyl-4-methyl-pentyl) 2,2-dimethylpropanoate

Systemtic Name: (4-cyano-1-ethoxycarbothioylsulfanyl-4-methyl-pentyl) 2,2-dimethylpropanoate Openeye Name: (4-cyano-1-ethoxycarbothioylsulfanyl-4-methyl-pentyl) 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [4-cyano-1-[[ethoxy(sulfanylidene)methyl]thio]-4-methylpentyl] ester IUPAC Name: (4-cyano-1-ethoxycarbothioylsulfanyl-4-methylpentyl) 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [4-cyano-1-(ethoxycarbothioylthio)-4-methyl-pentyl] ester Formula: C15H25NO3S2 MolecularWeight: 331.4939

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=S)SC(CCC(C)(C)C#N)OC(=O)C(C)(C)C

Isomeric SMILES

CCOC(=S)SC(CCC(C)(C)C#N)OC(=O)C(C)(C)C

InChI

InChI=1S/C15H25NO3S2/c1-7-18-13(20)21-11(8-9-15(5,6)10-16)19-12(17)14(2,3)4/h11H,7-9H2,1-6H3