(2-sulfanylidenepyridin-1-yl) 3-diphenoxyphosphoryloxy-2-methyl-2,3-diphenyl-propanoate

Systemtic Name: (2-sulfanylidenepyridin-1-yl) 3-diphenoxyphosphoryloxy-2-methyl-2,3-diphenyl-propanoate Openeye Name: (2-thioxo-1-pyridyl) 3-diphenoxyphosphoryloxy-2-methyl-2,3-diphenyl-propanoate CAS Name: 3-diphenoxyphosphoryloxy-2-methyl-2,3-diphenylpropanoic acid (2-sulfanylidene-1-pyridinyl) ester IUPAC Name: (2-sulfanylidenepyridin-1-yl) 3-diphenoxyphosphoryloxy-2-methyl-2,3-diphenylpropanoate Traditional Name: 3-diphenoxyphosphoryloxy-2-methyl-2,3-diphenyl-propionic acid (2-thioxo-1-pyridyl) ester Formula: C33H28NO6PS MolecularWeight: 597.617281

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)(C(C2=CC=CC=C2)OP(=O)(OC3=CC=CC=C3)OC4=CC=CC=C4)C(=O)ON5C=CC=CC5=S

Isomeric SMILES

CC(C1=CC=CC=C1)(C(C2=CC=CC=C2)OP(=O)(OC3=CC=CC=C3)OC4=CC=CC=C4)C(=O)ON5C=CC=CC5=S

InChI

InChI=1S/C33H28NO6PS/c1-33(27-18-8-3-9-19-27,32(35)37-34-25-15-14-24-30(34)42)31(26-16-6-2-7-17-26)40-41(36,38-28-20-10-4-11-21-28)39-29-22-12-5-13-23-29/h2-25,31H,1H3