(phenylmethyl) (2S,4S)-4-diphenylphosphinothioyl-2-[(4S)-4-propan-2-yl-4,5-dihydro-1,3-oxazol-2-yl]pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) (2S,4S)-4-diphenylphosphinothioyl-2-[(4S)-4-propan-2-yl-4,5-dihydro-1,3-oxazol-2-yl]pyrrolidine-1-carboxylate Openeye Name: benzyl (2S,4S)-4-diphenylphosphinothioyl-2-[(4S)-4-isopropyl-4,5-dihydrooxazol-2-yl]pyrrolidine-1-carboxylate CAS Name: (2S,4S)-4-diphenylphosphinothioyl-2-[(4S)-4-propan-2-yl-4,5-dihydrooxazol-2-yl]-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S,4S)-4-diphenylphosphinothioyl-2-[(4S)-4-propan-2-yl-4,5-dihydro-1,3-oxazol-2-yl]pyrrolidine-1-carboxylate Traditional Name: (2S,4S)-4-diphenylthiophosphoryl-2-[(4S)-4-isopropyl-2-oxazolin-2-yl]pyrrolidine-1-carboxylic acid benzyl ester Formula: C30H33N2O3PS MolecularWeight: 532.633381

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1COC(=N1)C2CC(CN2C(=O)OCC3=CC=CC=C3)P(=S)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC(C)[C@H]1COC(=N1)[C@@H]2C[C@@H](CN2C(=O)OCC3=CC=CC=C3)P(=S)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C30H33N2O3PS/c1-22(2)27-21-34-29(31-27)28-18-26(19-32(28)30(33)35-20-23-12-6-3-7-13-23)36(37,24-14-8-4-9-15-24)25-16-10-5-11-17-25/h3-17,22,26-28H,18-21H2,1-2H3/t26-,27+,28-/m0/s1