N-(1,3-benzothiazol-2-yl)-1-[2-(trifluoromethyl)phenyl]sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-1-[2-(trifluoromethyl)phenyl]sulfonyl-pyrrolidine-2-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-1-[2-(trifluoromethyl)phenyl]sulfonyl-pyrrolidine-2-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-1-[2-(trifluoromethyl)phenyl]sulfonyl-2-pyrrolidinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-1-[2-(trifluoromethyl)phenyl]sulfonylpyrrolidine-2-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-1-[2-(trifluoromethyl)phenyl]sulfonyl-pyrrolidine-2-carboxamide Formula: C19H16F3N3O3S2 MolecularWeight: 455.47385

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=CC=C2C(F)(F)F)C(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC=CC=C2C(F)(F)F)C(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H16F3N3O3S2/c20-19(21,22)12-6-1-4-10-16(12)30(27,28)25-11-5-8-14(25)17(26)24-18-23-13-7-2-3-9-15(13)29-18/h1-4,6-7,9-10,14H,5,8,11H2,(H,23,24,26)