methylsulfanylmethyl (2S)-3-diphenoxyphosphoryloxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: methylsulfanylmethyl (2S)-3-diphenoxyphosphoryloxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: methylsulfanylmethyl (2S)-2-(tert-butoxycarbonylamino)-3-diphenoxyphosphoryloxy-propanoate CAS Name: (2S)-3-diphenoxyphosphoryloxy-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid (methylthio)methyl ester IUPAC Name: methylsulfanylmethyl (2S)-3-diphenoxyphosphoryloxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-3-diphenoxyphosphoryloxy-propionic acid (methylthio)methyl ester Formula: C22H28NO8PS MolecularWeight: 497.498381

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(COP(=O)(OC1=CC=CC=C1)OC2=CC=CC=C2)C(=O)OCSC

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](COP(=O)(OC1=CC=CC=C1)OC2=CC=CC=C2)C(=O)OCSC

InChI

InChI=1S/C22H28NO8PS/c1-22(2,3)29-21(25)23-19(20(24)27-16-33-4)15-28-32(26,30-17-11-7-5-8-12-17)31-18-13-9-6-10-14-18/h5-14,19H,15-16H2,1-4H3,(H,23,25)/t19-/m0/s1