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

Systemtic Name: (2S)-1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-N-phenyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-phenyl-pyrrolidine-2-carboxamide CAS Name: (2S)-1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-phenyl-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-phenylpyrrolidine-2-carboxamide Traditional Name: (2S)-1-(1,1-diketo-1,2-benzothiazol-3-yl)-N-phenyl-pyrrolidine-2-carboxamide Formula: C18H17N3O3S MolecularWeight: 355.41088

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2=NS(=O)(=O)C3=CC=CC=C32)C(=O)NC4=CC=CC=C4

Isomeric SMILES

C1C[C@H](N(C1)C2=NS(=O)(=O)C3=CC=CC=C32)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C18H17N3O3S/c22-18(19-13-7-2-1-3-8-13)15-10-6-12-21(15)17-14-9-4-5-11-16(14)25(23,24)20-17/h1-5,7-9,11,15H,6,10,12H2,(H,19,22)/t15-/m0/s1