(phenylmethyl) 2-[diphenoxyphosphorylmethyl-(4-methylphenyl)sulfanyl-amino]ethanoate

Systemtic Name: (phenylmethyl) 2-[diphenoxyphosphorylmethyl-(4-methylphenyl)sulfanyl-amino]ethanoate Openeye Name: benzyl 2-[diphenoxyphosphorylmethyl(p-tolylsulfanyl)amino]acetate CAS Name: 2-[diphenoxyphosphorylmethyl-[(4-methylphenyl)thio]amino]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[diphenoxyphosphorylmethyl-(4-methylphenyl)sulfanylamino]acetate Traditional Name: 2-[diphenoxyphosphorylmethyl-(p-tolylthio)amino]acetic acid benzyl ester Formula: C29H28NO5PS MolecularWeight: 533.575081

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SN(CC(=O)OCC2=CC=CC=C2)CP(=O)(OC3=CC=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)SN(CC(=O)OCC2=CC=CC=C2)CP(=O)(OC3=CC=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C29H28NO5PS/c1-24-17-19-28(20-18-24)37-30(21-29(31)33-22-25-11-5-2-6-12-25)23-36(32,34-26-13-7-3-8-14-26)35-27-15-9-4-10-16-27/h2-20H,21-23H2,1H3