2-[[(2S,3S)-3-(diethoxyphosphorylmethyl)-5-phenylsulfanyl-oxolan-2-yl]methoxy]-4-methoxy-pyrimidine

Systemtic Name: 2-[[(2S,3S)-3-(diethoxyphosphorylmethyl)-5-phenylsulfanyl-oxolan-2-yl]methoxy]-4-methoxy-pyrimidine Openeye Name: 2-[[(2S,3S)-3-(diethoxyphosphorylmethyl)-5-phenylsulfanyl-tetrahydrofuran-2-yl]methoxy]-4-methoxy-pyrimidine CAS Name: 2-[[(2S,3S)-3-(diethoxyphosphorylmethyl)-5-(phenylthio)-2-oxolanyl]methoxy]-4-methoxypyrimidine IUPAC Name: 2-[[(2S,3S)-3-(diethoxyphosphorylmethyl)-5-phenylsulfanyloxolan-2-yl]methoxy]-4-methoxypyrimidine Traditional Name: 2-[[(2S,3S)-3-(diethoxyphosphorylmethyl)-5-(phenylthio)tetrahydrofuran-2-yl]methoxy]-4-methoxy-pyrimidine Formula: C21H29N2O6PS MolecularWeight: 468.503521

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CC1CC(OC1COC2=NC=CC(=N2)OC)SC3=CC=CC=C3)OCC

Isomeric SMILES

CCOP(=O)(C[C@H]1CC(O[C@@H]1COC2=NC=CC(=N2)OC)SC3=CC=CC=C3)OCC

InChI

InChI=1S/C21H29N2O6PS/c1-4-27-30(24,28-5-2)15-16-13-20(31-17-9-7-6-8-10-17)29-18(16)14-26-21-22-12-11-19(23-21)25-3/h6-12,16,18,20H,4-5,13-15H2,1-3H3/t16-,18-,20?/m1/s1