1-(4-chlorophenyl)sulfonyl-N-(4-fluoranyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)pyrrolidine-2-carboxamide

Systemtic Name: 1-(4-chlorophenyl)sulfonyl-N-(4-fluoranyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)pyrrolidine-2-carboxamide Openeye Name: N-benzyl-1-(4-chlorophenyl)sulfonyl-N-(4-fluoro-1,3-benzothiazol-2-yl)pyrrolidine-2-carboxamide CAS Name: 1-(4-chlorophenyl)sulfonyl-N-(4-fluoro-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-2-pyrrolidinecarboxamide IUPAC Name: N-benzyl-1-(4-chlorophenyl)sulfonyl-N-(4-fluoro-1,3-benzothiazol-2-yl)pyrrolidine-2-carboxamide Traditional Name: N-benzyl-1-(4-chlorophenyl)sulfonyl-N-(4-fluoro-1,3-benzothiazol-2-yl)pyrrolidine-2-carboxamide Formula: C25H21ClFN3O3S2 MolecularWeight: 530.033943

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)Cl)C(=O)N(CC3=CC=CC=C3)C4=NC5=C(C=CC=C5S4)F

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)Cl)C(=O)N(CC3=CC=CC=C3)C4=NC5=C(C=CC=C5S4)F

InChI

InChI=1S/C25H21ClFN3O3S2/c26-18-11-13-19(14-12-18)35(32,33)30-15-5-9-21(30)24(31)29(16-17-6-2-1-3-7-17)25-28-23-20(27)8-4-10-22(23)34-25/h1-4,6-8,10-14,21H,5,9,15-16H2