2-[(2R)-1-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpyrrolidin-2-yl]-1,3-benzothiazole

Systemtic Name: 2-[(2R)-1-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpyrrolidin-2-yl]-1,3-benzothiazole Openeye Name: 2-[(2R)-1-(3-chloro-4-fluoro-phenyl)sulfonylpyrrolidin-2-yl]-1,3-benzothiazole CAS Name: 2-[(2R)-1-(3-chloro-4-fluorophenyl)sulfonyl-2-pyrrolidinyl]-1,3-benzothiazole IUPAC Name: 2-[(2R)-1-(3-chloro-4-fluorophenyl)sulfonylpyrrolidin-2-yl]-1,3-benzothiazole Traditional Name: 2-[(2R)-1-(3-chloro-4-fluoro-phenyl)sulfonylpyrrolidin-2-yl]-1,3-benzothiazole Formula: C17H14ClFN2O2S2 MolecularWeight: 396.886663

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC(=C(C=C2)F)Cl)C3=NC4=CC=CC=C4S3

Isomeric SMILES

C1C[C@@H](N(C1)S(=O)(=O)C2=CC(=C(C=C2)F)Cl)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C17H14ClFN2O2S2/c18-12-10-11(7-8-13(12)19)25(22,23)21-9-3-5-15(21)17-20-14-4-1-2-6-16(14)24-17/h1-2,4,6-8,10,15H,3,5,9H2/t15-/m1/s1