(3S)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-5-oxidanylidene-1-phenyl-pyrrolidine-3-carboxamide

Systemtic Name: (3S)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-5-oxidanylidene-1-phenyl-pyrrolidine-3-carboxamide Openeye Name: (3S)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-5-oxo-1-phenyl-pyrrolidine-3-carboxamide CAS Name: (3S)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-5-oxo-1-phenyl-3-pyrrolidinecarboxamide IUPAC Name: (3S)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-5-oxo-1-phenylpyrrolidine-3-carboxamide Traditional Name: (3S)-5-keto-N-(6-mesyl-1,3-benzothiazol-2-yl)-1-phenyl-pyrrolidine-3-carboxamide Formula: C19H17N3O4S2 MolecularWeight: 415.48598

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3CC(=O)N(C3)C4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)[C@H]3CC(=O)N(C3)C4=CC=CC=C4

InChI

InChI=1S/C19H17N3O4S2/c1-28(25,26)14-7-8-15-16(10-14)27-19(20-15)21-18(24)12-9-17(23)22(11-12)13-5-3-2-4-6-13/h2-8,10,12H,9,11H2,1H3,(H,20,21,24)/t12-/m0/s1