ethyl 4-[2-chloranyl-5-(dimethylsulfamoyl)phenyl]carbonylthiomorpholine-3-carboxylate

Systemtic Name: ethyl 4-[2-chloranyl-5-(dimethylsulfamoyl)phenyl]carbonylthiomorpholine-3-carboxylate Openeye Name: ethyl 4-[2-chloro-5-(dimethylsulfamoyl)benzoyl]thiomorpholine-3-carboxylate CAS Name: 4-[[2-chloro-5-(dimethylsulfamoyl)phenyl]-oxomethyl]-3-thiomorpholinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-chloro-5-(dimethylsulfamoyl)benzoyl]thiomorpholine-3-carboxylate Traditional Name: 4-[2-chloro-5-(dimethylsulfamoyl)benzoyl]thiomorpholine-3-carboxylic acid ethyl ester Formula: C16H21ClN2O5S2 MolecularWeight: 420.93134

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CSCCN1C(=O)C2=C(C=CC(=C2)S(=O)(=O)N(C)C)Cl

Isomeric SMILES

CCOC(=O)C1CSCCN1C(=O)C2=C(C=CC(=C2)S(=O)(=O)N(C)C)Cl

InChI

InChI=1S/C16H21ClN2O5S2/c1-4-24-16(21)14-10-25-8-7-19(14)15(20)12-9-11(5-6-13(12)17)26(22,23)18(2)3/h5-6,9,14H,4,7-8,10H2,1-3H3