ethyl 2-[bis[(3-methoxyphenyl)sulfanyl]phosphorylmethyl-(phenylmethylsulfanyl)carbonyl-amino]ethanoate

Systemtic Name: ethyl 2-[bis[(3-methoxyphenyl)sulfanyl]phosphorylmethyl-(phenylmethylsulfanyl)carbonyl-amino]ethanoate Openeye Name: ethyl 2-[benzylsulfanylcarbonyl-[bis[(3-methoxyphenyl)sulfanyl]phosphorylmethyl]amino]acetate CAS Name: 2-[bis[(3-methoxyphenyl)thio]phosphorylmethyl-[oxo-(phenylmethylthio)methyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[benzylsulfanylcarbonyl-[bis[(3-methoxyphenyl)sulfanyl]phosphorylmethyl]amino]acetate Traditional Name: 2-[(benzylthio)carbonyl-[bis[(3-methoxyphenyl)thio]phosphorylmethyl]amino]acetic acid ethyl ester Formula: C27H30NO6PS3 MolecularWeight: 591.698961

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(CP(=O)(SC1=CC=CC(=C1)OC)SC2=CC=CC(=C2)OC)C(=O)SCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CN(CP(=O)(SC1=CC=CC(=C1)OC)SC2=CC=CC(=C2)OC)C(=O)SCC3=CC=CC=C3

InChI

InChI=1S/C27H30NO6PS3/c1-4-34-26(29)18-28(27(30)36-19-21-10-6-5-7-11-21)20-35(31,37-24-14-8-12-22(16-24)32-2)38-25-15-9-13-23(17-25)33-3/h5-17H,4,18-20H2,1-3H3