2,2-dimethylpropanoyloxymethyl 2-azanyl-3-[2-(ethanoylsulfanylmethyl)-3-pyridin-3-yl-propanoyl]benzoate

Systemtic Name: 2,2-dimethylpropanoyloxymethyl 2-azanyl-3-[2-(ethanoylsulfanylmethyl)-3-pyridin-3-yl-propanoyl]benzoate Openeye Name: 2,2-dimethylpropanoyloxymethyl 3-[2-(acetylsulfanylmethyl)-3-(3-pyridyl)propanoyl]-2-amino-benzoate CAS Name: 3-[2-[(acetylthio)methyl]-1-oxo-3-(3-pyridinyl)propyl]-2-aminobenzoic acid (2,2-dimethyl-1-oxopropoxy)methyl ester IUPAC Name: 2,2-dimethylpropanoyloxymethyl 3-[2-(acetylsulfanylmethyl)-3-pyridin-3-ylpropanoyl]-2-aminobenzoate Traditional Name: 3-[2-[(acetylthio)methyl]-3-(3-pyridyl)propanoyl]-2-amino-benzoic acid pivaloyloxymethyl ester Formula: C24H28N2O6S MolecularWeight: 472.55392

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(CC1=CN=CC=C1)C(=O)C2=C(C(=CC=C2)C(=O)OCOC(=O)C(C)(C)C)N

Isomeric SMILES

CC(=O)SCC(CC1=CN=CC=C1)C(=O)C2=C(C(=CC=C2)C(=O)OCOC(=O)C(C)(C)C)N

InChI

InChI=1S/C24H28N2O6S/c1-15(27)33-13-17(11-16-7-6-10-26-12-16)21(28)18-8-5-9-19(20(18)25)22(29)31-14-32-23(30)24(2,3)4/h5-10,12,17H,11,13-14,25H2,1-4H3