ethyl 2-[bis(phenylsulfanyl)phosphorylmethyl-(phenylmethylsulfanyl)carbonyl-amino]ethanoate

Systemtic Name: ethyl 2-[bis(phenylsulfanyl)phosphorylmethyl-(phenylmethylsulfanyl)carbonyl-amino]ethanoate Openeye Name: ethyl 2-[benzylsulfanylcarbonyl-[bis(phenylsulfanyl)phosphorylmethyl]amino]acetate CAS Name: 2-[bis(phenylthio)phosphorylmethyl-[oxo-(phenylmethylthio)methyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[benzylsulfanylcarbonyl-[bis(phenylsulfanyl)phosphorylmethyl]amino]acetate Traditional Name: 2-[(benzylthio)carbonyl-[bis(phenylthio)phosphorylmethyl]amino]acetic acid ethyl ester Formula: C25H26NO4PS3 MolecularWeight: 531.647001

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H26NO4PS3/c1-2-30-24(27)18-26(25(28)32-19-21-12-6-3-7-13-21)20-31(29,33-22-14-8-4-9-15-22)34-23-16-10-5-11-17-23/h3-17H,2,18-20H2,1H3