ethyl 2-diethoxyphosphoryl-3-[2-(4-fluorophenyl)-1-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-methyl-pentanoate

Systemtic Name: ethyl 2-diethoxyphosphoryl-3-[2-(4-fluorophenyl)-1-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-methyl-pentanoate Openeye Name: ethyl 2-diethoxyphosphoryl-3-[2-(4-fluorophenyl)-1-(4-methoxyphenyl)-2-oxo-ethyl]sulfanyl-4-methyl-pentanoate CAS Name: 2-diethoxyphosphoryl-3-[[2-(4-fluorophenyl)-1-(4-methoxyphenyl)-2-oxoethyl]thio]-4-methylpentanoic acid ethyl ester IUPAC Name: ethyl 2-diethoxyphosphoryl-3-[2-(4-fluorophenyl)-1-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-4-methylpentanoate Traditional Name: 2-diethoxyphosphoryl-3-[[2-(4-fluorophenyl)-2-keto-1-(4-methoxyphenyl)ethyl]thio]-4-methyl-valeric acid ethyl ester Formula: C27H36FO7PS MolecularWeight: 554.607704

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C(C)C)SC(C1=CC=C(C=C1)OC)C(=O)C2=CC=C(C=C2)F)P(=O)(OCC)OCC

Isomeric SMILES

CCOC(=O)C(C(C(C)C)SC(C1=CC=C(C=C1)OC)C(=O)C2=CC=C(C=C2)F)P(=O)(OCC)OCC

InChI

InChI=1S/C27H36FO7PS/c1-7-33-27(30)24(36(31,34-8-2)35-9-3)25(18(4)5)37-26(20-12-16-22(32-6)17-13-20)23(29)19-10-14-21(28)15-11-19/h10-18,24-26H,7-9H2,1-6H3