1-(2,2-dimethylpropanoyl)-N-[2-(2-methoxyethoxymethylsulfanyl)-1,3-benzothiazol-6-yl]pyrrolidine-2-carboxamide

Systemtic Name: 1-(2,2-dimethylpropanoyl)-N-[2-(2-methoxyethoxymethylsulfanyl)-1,3-benzothiazol-6-yl]pyrrolidine-2-carboxamide Openeye Name: 1-(2,2-dimethylpropanoyl)-N-[2-(2-methoxyethoxymethylsulfanyl)-1,3-benzothiazol-6-yl]pyrrolidine-2-carboxamide CAS Name: 1-(2,2-dimethyl-1-oxopropyl)-N-[2-(2-methoxyethoxymethylthio)-1,3-benzothiazol-6-yl]-2-pyrrolidinecarboxamide IUPAC Name: 1-(2,2-dimethylpropanoyl)-N-[2-(2-methoxyethoxymethylsulfanyl)-1,3-benzothiazol-6-yl]pyrrolidine-2-carboxamide Traditional Name: N-[2-(2-methoxyethoxymethylthio)-1,3-benzothiazol-6-yl]-1-pivaloyl-pyrrolidine-2-carboxamide Formula: C21H29N3O4S2 MolecularWeight: 451.60266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)N1CCCC1C(=O)NC2=CC3=C(C=C2)N=C(S3)SCOCCOC

Isomeric SMILES

CC(C)(C)C(=O)N1CCCC1C(=O)NC2=CC3=C(C=C2)N=C(S3)SCOCCOC

InChI

InChI=1S/C21H29N3O4S2/c1-21(2,3)19(26)24-9-5-6-16(24)18(25)22-14-7-8-15-17(12-14)30-20(23-15)29-13-28-11-10-27-4/h7-8,12,16H,5-6,9-11,13H2,1-4H3,(H,22,25)