(3S)-N-(1,3-benzothiazol-2-yl)-1-[4-(diethylsulfamoyl)phenyl]-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: (3S)-N-(1,3-benzothiazol-2-yl)-1-[4-(diethylsulfamoyl)phenyl]-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: (3S)-N-(1,3-benzothiazol-2-yl)-1-[4-(diethylsulfamoyl)phenyl]-5-oxo-pyrrolidine-3-carboxamide CAS Name: (3S)-N-(1,3-benzothiazol-2-yl)-1-[4-(diethylsulfamoyl)phenyl]-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: (3S)-N-(1,3-benzothiazol-2-yl)-1-[4-(diethylsulfamoyl)phenyl]-5-oxopyrrolidine-3-carboxamide Traditional Name: (3S)-N-(1,3-benzothiazol-2-yl)-1-[4-(diethylsulfamoyl)phenyl]-5-keto-pyrrolidine-3-carboxamide Formula: C22H24N4O4S2 MolecularWeight: 472.58036

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)N2CC(CC2=O)C(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)N2C[C@H](CC2=O)C(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H24N4O4S2/c1-3-25(4-2)32(29,30)17-11-9-16(10-12-17)26-14-15(13-20(26)27)21(28)24-22-23-18-7-5-6-8-19(18)31-22/h5-12,15H,3-4,13-14H2,1-2H3,(H,23,24,28)/t15-/m0/s1