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

Systemtic Name: (2S)-N-(1,3-benzothiazol-2-yl)-N-methyl-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-N-(1,3-benzothiazol-2-yl)-N-methyl-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide CAS Name: (2S)-N-(1,3-benzothiazol-2-yl)-N-methyl-1-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-(1,3-benzothiazol-2-yl)-N-methyl-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide Traditional Name: (2S)-N-(1,3-benzothiazol-2-yl)-N-methyl-1-(2-thenoyl)pyrrolidine-2-carboxamide Formula: C18H17N3O2S2 MolecularWeight: 371.47648

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17N3O2S2/c1-20(18-19-12-6-2-3-8-14(12)25-18)16(22)13-7-4-10-21(13)17(23)15-9-5-11-24-15/h2-3,5-6,8-9,11,13H,4,7,10H2,1H3/t13-/m0/s1