N-(1,3-benzothiazol-2-yl)-1-(phenylsulfonyl)pyrrolidine-2-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-1-(phenylsulfonyl)pyrrolidine-2-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-(1,3-benzothiazol-2-yl)pyrrolidine-2-carboxamide CAS Name: 1-(benzenesulfonyl)-N-(1,3-benzothiazol-2-yl)-2-pyrrolidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-(1,3-benzothiazol-2-yl)pyrrolidine-2-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-1-besyl-pyrrolidine-2-carboxamide Formula: C18H17N3O3S2 MolecularWeight: 387.47588

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H17N3O3S2/c22-17(20-18-19-14-9-4-5-11-16(14)25-18)15-10-6-12-21(15)26(23,24)13-7-2-1-3-8-13/h1-5,7-9,11,15H,6,10,12H2,(H,19,20,22)