S-[(2S)-2-methyl-3-oxidanylidene-propyl] 2-methoxy-5-sulfamoyl-benzenecarbothioate

Systemtic Name: S-[(2S)-2-methyl-3-oxidanylidene-propyl] 2-methoxy-5-sulfamoyl-benzenecarbothioate Openeye Name: S-[(2S)-2-methyl-3-oxo-propyl] 2-methoxy-5-sulfamoyl-benzenecarbothioate CAS Name: 2-methoxy-5-sulfamoylbenzenecarbothioic acid S-[(2S)-2-methyl-3-oxopropyl] ester IUPAC Name: S-[(2S)-2-methyl-3-oxopropyl] 2-methoxy-5-sulfamoylbenzenecarbothioate Traditional Name: 2-methoxy-5-sulfamoyl-thiobenzoic acid S-[(2S)-3-keto-2-methyl-propyl] ester Formula: C12H15NO5S2 MolecularWeight: 317.3812

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC(=O)C1=C(C=CC(=C1)S(=O)(=O)N)OC)C=O

Isomeric SMILES

C[C@H](CSC(=O)C1=C(C=CC(=C1)S(=O)(=O)N)OC)C=O

InChI

InChI=1S/C12H15NO5S2/c1-8(6-14)7-19-12(15)10-5-9(20(13,16)17)3-4-11(10)18-2/h3-6,8H,7H2,1-2H3,(H2,13,16,17)/t8-/m0/s1