phenacyl (2R)-2-[(4-nitrophenyl)sulfonylamino]-3-(phenylmethylsulfanyl)propanoate

Systemtic Name: phenacyl (2R)-2-[(4-nitrophenyl)sulfonylamino]-3-(phenylmethylsulfanyl)propanoate Openeye Name: phenacyl (2R)-3-benzylsulfanyl-2-[(4-nitrophenyl)sulfonylamino]propanoate CAS Name: (2R)-2-[(4-nitrophenyl)sulfonylamino]-3-(phenylmethylthio)propanoic acid phenacyl ester IUPAC Name: phenacyl (2R)-3-benzylsulfanyl-2-[(4-nitrophenyl)sulfonylamino]propanoate Traditional Name: (2R)-3-(benzylthio)-2-(nosylamino)propionic acid phenacyl ester Formula: C24H22N2O7S2 MolecularWeight: 514.57068

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCC(C(=O)OCC(=O)C2=CC=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CSC[C@@H](C(=O)OCC(=O)C2=CC=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C24H22N2O7S2/c27-23(19-9-5-2-6-10-19)15-33-24(28)22(17-34-16-18-7-3-1-4-8-18)25-35(31,32)21-13-11-20(12-14-21)26(29)30/h1-14,22,25H,15-17H2/t22-/m0/s1