2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-methyl-amino]ethyl 5-oxidanylidene-1-phenyl-pyrrolidine-3-carboxylate

Systemtic Name: 2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-methyl-amino]ethyl 5-oxidanylidene-1-phenyl-pyrrolidine-3-carboxylate Openeye Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)-methyl-amino]ethyl 5-oxo-1-phenyl-pyrrolidine-3-carboxylate CAS Name: 5-oxo-1-phenyl-3-pyrrolidinecarboxylic acid 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)-methylamino]ethyl ester IUPAC Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)-methylamino]ethyl 5-oxo-1-phenylpyrrolidine-3-carboxylate Traditional Name: 5-keto-1-phenyl-pyrrolidine-3-carboxylic acid 2-[(1,1-diketo-1,2-benzothiazol-3-yl)-methyl-amino]ethyl ester Formula: C21H21N3O5S MolecularWeight: 427.47354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCOC(=O)C1CC(=O)N(C1)C2=CC=CC=C2)C3=NS(=O)(=O)C4=CC=CC=C43

Isomeric SMILES

CN(CCOC(=O)C1CC(=O)N(C1)C2=CC=CC=C2)C3=NS(=O)(=O)C4=CC=CC=C43

InChI

InChI=1S/C21H21N3O5S/c1-23(20-17-9-5-6-10-18(17)30(27,28)22-20)11-12-29-21(26)15-13-19(25)24(14-15)16-7-3-2-4-8-16/h2-10,15H,11-14H2,1H3