methyl (2R)-2-acetamido-3-[(2-diphenylphosphorylphenyl)carbonylamino]sulfanyl-3-methyl-butanoate

Systemtic Name: methyl (2R)-2-acetamido-3-[(2-diphenylphosphorylphenyl)carbonylamino]sulfanyl-3-methyl-butanoate Openeye Name: methyl (2R)-2-acetamido-3-[(2-diphenylphosphorylbenzoyl)amino]sulfanyl-3-methyl-butanoate CAS Name: (2R)-2-acetamido-3-[[[(2-diphenylphosphorylphenyl)-oxomethyl]amino]thio]-3-methylbutanoic acid methyl ester IUPAC Name: methyl (2R)-2-acetamido-3-[(2-diphenylphosphorylbenzoyl)amino]sulfanyl-3-methylbutanoate Traditional Name: (2R)-2-acetamido-3-[[(2-diphenylphosphorylbenzoyl)amino]thio]-3-methyl-butyric acid methyl ester Formula: C27H29N2O5PS MolecularWeight: 524.568321

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(C(=O)OC)C(C)(C)SNC(=O)C1=CC=CC=C1P(=O)(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(=O)N[C@H](C(=O)OC)C(C)(C)SNC(=O)C1=CC=CC=C1P(=O)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C27H29N2O5PS/c1-19(30)28-24(26(32)34-4)27(2,3)36-29-25(31)22-17-11-12-18-23(22)35(33,20-13-7-5-8-14-20)21-15-9-6-10-16-21/h5-18,24H,1-4H3,(H,28,30)(H,29,31)/t24-/m1/s1