ethyl 2-diethoxyphosphoryl-4-ethoxycarbothioylsulfanyl-5-(1-methyl-2-oxidanylidene-cyclohexyl)pentanoate

Systemtic Name: ethyl 2-diethoxyphosphoryl-4-ethoxycarbothioylsulfanyl-5-(1-methyl-2-oxidanylidene-cyclohexyl)pentanoate Openeye Name: ethyl 2-diethoxyphosphoryl-4-ethoxycarbothioylsulfanyl-5-(1-methyl-2-oxo-cyclohexyl)pentanoate CAS Name: 2-diethoxyphosphoryl-4-[[ethoxy(sulfanylidene)methyl]thio]-5-(1-methyl-2-oxocyclohexyl)pentanoic acid ethyl ester IUPAC Name: ethyl 2-diethoxyphosphoryl-4-ethoxycarbothioylsulfanyl-5-(1-methyl-2-oxocyclohexyl)pentanoate Traditional Name: 2-diethoxyphosphoryl-4-(ethoxycarbothioylthio)-5-(2-keto-1-methyl-cyclohexyl)valeric acid ethyl ester Formula: C21H37O7PS2 MolecularWeight: 496.618041

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(CC1(CCCCC1=O)C)SC(=S)OCC)P(=O)(OCC)OCC

Isomeric SMILES

CCOC(=O)C(CC(CC1(CCCCC1=O)C)SC(=S)OCC)P(=O)(OCC)OCC

InChI

InChI=1S/C21H37O7PS2/c1-6-25-19(23)17(29(24,27-8-3)28-9-4)14-16(31-20(30)26-7-2)15-21(5)13-11-10-12-18(21)22/h16-17H,6-15H2,1-5H3