(2S)-N-(1,3-benzothiazol-2-yl)-N-ethyl-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-(1,3-benzothiazol-2-yl)-N-ethyl-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-N-(1,3-benzothiazol-2-yl)-N-ethyl-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide CAS Name: (2S)-N-(1,3-benzothiazol-2-yl)-N-ethyl-1-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-(1,3-benzothiazol-2-yl)-N-ethyl-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide Traditional Name: (2S)-N-(1,3-benzothiazol-2-yl)-N-ethyl-1-(2-thenoyl)pyrrolidine-2-carboxamide Formula: C19H19N3O2S2 MolecularWeight: 385.50306

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=NC2=CC=CC=C2S1)C(=O)C3CCCN3C(=O)C4=CC=CS4

Isomeric SMILES

CCN(C1=NC2=CC=CC=C2S1)C(=O)[C@@H]3CCCN3C(=O)C4=CC=CS4

InChI

InChI=1S/C19H19N3O2S2/c1-2-21(19-20-13-7-3-4-9-15(13)26-19)17(23)14-8-5-11-22(14)18(24)16-10-6-12-25-16/h3-4,6-7,9-10,12,14H,2,5,8,11H2,1H3/t14-/m0/s1