2-[(2S)-1-(3-bromophenyl)sulfonylpyrrolidin-2-yl]-1,3-benzothiazole

Systemtic Name: 2-[(2S)-1-(3-bromophenyl)sulfonylpyrrolidin-2-yl]-1,3-benzothiazole Openeye Name: 2-[(2S)-1-(3-bromophenyl)sulfonylpyrrolidin-2-yl]-1,3-benzothiazole CAS Name: 2-[(2S)-1-(3-bromophenyl)sulfonyl-2-pyrrolidinyl]-1,3-benzothiazole IUPAC Name: 2-[(2S)-1-(3-bromophenyl)sulfonylpyrrolidin-2-yl]-1,3-benzothiazole Traditional Name: 2-[(2S)-1-(3-bromophenyl)sulfonylpyrrolidin-2-yl]-1,3-benzothiazole Formula: C17H15BrN2O2S2 MolecularWeight: 423.3472

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC(=CC=C2)Br)C3=NC4=CC=CC=C4S3

Isomeric SMILES

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

InChI

InChI=1S/C17H15BrN2O2S2/c18-12-5-3-6-13(11-12)24(21,22)20-10-4-8-15(20)17-19-14-7-1-2-9-16(14)23-17/h1-3,5-7,9,11,15H,4,8,10H2/t15-/m0/s1