[4-chloranyl-3-di(propan-2-yl)phosphinothioylsulfanyl-5-oxidanylidene-2H-furan-2-yl] 2-bromanylbenzoate

Systemtic Name: [4-chloranyl-3-di(propan-2-yl)phosphinothioylsulfanyl-5-oxidanylidene-2H-furan-2-yl] 2-bromanylbenzoate Openeye Name: (4-chloro-3-diisopropylphosphinothioylsulfanyl-5-oxo-2H-furan-2-yl) 2-bromobenzoate CAS Name: 2-bromobenzoic acid [4-chloro-3-[di(propan-2-yl)phosphinothioylthio]-5-oxo-2H-furan-2-yl] ester IUPAC Name: [4-chloro-3-di(propan-2-yl)phosphinothioylsulfanyl-5-oxo-2H-furan-2-yl] 2-bromobenzoate Traditional Name: 2-bromobenzoic acid [4-chloro-3-(diisopropylthiophosphorylthio)-5-keto-2H-furan-2-yl] ester Formula: C17H19BrClO4PS2 MolecularWeight: 497.791121

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)P(=S)(C(C)C)SC1=C(C(=O)OC1OC(=O)C2=CC=CC=C2Br)Cl

Isomeric SMILES

CC(C)P(=S)(C(C)C)SC1=C(C(=O)OC1OC(=O)C2=CC=CC=C2Br)Cl

InChI

InChI=1S/C17H19BrClO4PS2/c1-9(2)24(25,10(3)4)26-14-13(19)16(21)23-17(14)22-15(20)11-7-5-6-8-12(11)18/h5-10,17H,1-4H3