S-propyl 3-[[(2R)-4-bis(phenylmethoxy)phosphoryloxy-3,3-dimethyl-2-oxidanyl-butanoyl]amino]propanethioate

Systemtic Name: S-propyl 3-[[(2R)-4-bis(phenylmethoxy)phosphoryloxy-3,3-dimethyl-2-oxidanyl-butanoyl]amino]propanethioate Openeye Name: S-propyl 3-[[(2R)-4-dibenzyloxyphosphoryloxy-2-hydroxy-3,3-dimethyl-butanoyl]amino]propanethioate CAS Name: 3-[[(2R)-4-bis(phenylmethoxy)phosphoryloxy-2-hydroxy-3,3-dimethyl-1-oxobutyl]amino]propanethioic acid S-propyl ester IUPAC Name: S-propyl 3-[[(2R)-4-bis(phenylmethoxy)phosphoryloxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanethioate Traditional Name: 3-[[(2R)-4-dibenzoxyphosphoryloxy-2-hydroxy-3,3-dimethyl-butanoyl]amino]propanethioic acid S-propyl ester Formula: C26H36NO7PS MolecularWeight: 537.605301

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCSC(=O)CCNC(=O)C(C(C)(C)COP(=O)(OCC1=CC=CC=C1)OCC2=CC=CC=C2)O

Isomeric SMILES

CCCSC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)(OCC1=CC=CC=C1)OCC2=CC=CC=C2)O

InChI

InChI=1S/C26H36NO7PS/c1-4-17-36-23(28)15-16-27-25(30)24(29)26(2,3)20-34-35(31,32-18-21-11-7-5-8-12-21)33-19-22-13-9-6-10-14-22/h5-14,24,29H,4,15-20H2,1-3H3,(H,27,30)/t24-/m0/s1