methyl (2R)-2-[(2-phenyl-3H-benzimidazol-5-yl)sulfonylamino]-3-(phenylmethylsulfanyl)propanoate

Systemtic Name: methyl (2R)-2-[(2-phenyl-3H-benzimidazol-5-yl)sulfonylamino]-3-(phenylmethylsulfanyl)propanoate Openeye Name: methyl (2R)-3-benzylsulfanyl-2-[(2-phenyl-3H-benzimidazol-5-yl)sulfonylamino]propanoate CAS Name: (2R)-2-[(2-phenyl-3H-benzimidazol-5-yl)sulfonylamino]-3-(phenylmethylthio)propanoic acid methyl ester IUPAC Name: methyl (2R)-3-benzylsulfanyl-2-[(2-phenyl-3H-benzimidazol-5-yl)sulfonylamino]propanoate Traditional Name: (2R)-3-(benzylthio)-2-[(2-phenyl-3H-benzimidazol-5-yl)sulfonylamino]propionic acid methyl ester Formula: C24H23N3O4S2 MolecularWeight: 481.58712

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CSCC1=CC=CC=C1)NS(=O)(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)[C@H](CSCC1=CC=CC=C1)NS(=O)(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=CC=C4

InChI

InChI=1S/C24H23N3O4S2/c1-31-24(28)22(16-32-15-17-8-4-2-5-9-17)27-33(29,30)19-12-13-20-21(14-19)26-23(25-20)18-10-6-3-7-11-18/h2-14,22,27H,15-16H2,1H3,(H,25,26)/t22-/m0/s1