(4-methylsulfanylphenyl) 4-[ethoxy(propylsulfanyl)phosphinothioyl]oxybenzenesulfonate

Systemtic Name: (4-methylsulfanylphenyl) 4-[ethoxy(propylsulfanyl)phosphinothioyl]oxybenzenesulfonate Openeye Name: (4-methylsulfanylphenyl) 4-[ethoxy(propylsulfanyl)phosphinothioyl]oxybenzenesulfonate CAS Name: 4-[ethoxy-(propylthio)phosphinothioyl]oxybenzenesulfonic acid [4-(methylthio)phenyl] ester IUPAC Name: (4-methylsulfanylphenyl) 4-[ethoxy(propylsulfanyl)phosphinothioyl]oxybenzenesulfonate Traditional Name: 4-[ethoxy-(propylthio)thiophosphoryl]oxybenzenesulfonic acid [4-(methylthio)phenyl] ester Formula: C18H23O5PS4 MolecularWeight: 478.605981

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Descriptors Computed from Structure

Canonical SMILES:

CCCSP(=S)(OCC)OC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)SC

Isomeric SMILES

CCCSP(=S)(OCC)OC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)SC

InChI

InChI=1S/C18H23O5PS4/c1-4-14-27-24(25,21-5-2)22-15-8-12-18(13-9-15)28(19,20)23-16-6-10-17(26-3)11-7-16/h6-13H,4-5,14H2,1-3H3