phenyl (2S)-1-(2,1,3-benzothiadiazol-4-ylsulfonyl)pyrrolidine-2-carboxylate

Systemtic Name: phenyl (2S)-1-(2,1,3-benzothiadiazol-4-ylsulfonyl)pyrrolidine-2-carboxylate Openeye Name: phenyl (2S)-1-(2,1,3-benzothiadiazol-4-ylsulfonyl)pyrrolidine-2-carboxylate CAS Name: (2S)-1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-2-pyrrolidinecarboxylic acid phenyl ester IUPAC Name: phenyl (2S)-1-(2,1,3-benzothiadiazol-4-ylsulfonyl)pyrrolidine-2-carboxylate Traditional Name: (2S)-1-piazthiol-4-ylsulfonylpyrrolidine-2-carboxylic acid phenyl ester Formula: C17H15N3O4S2 MolecularWeight: 389.4487

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=CC3=NSN=C32)C(=O)OC4=CC=CC=C4

Isomeric SMILES

C1C[C@H](N(C1)S(=O)(=O)C2=CC=CC3=NSN=C32)C(=O)OC4=CC=CC=C4

InChI

InChI=1S/C17H15N3O4S2/c21-17(24-12-6-2-1-3-7-12)14-9-5-11-20(14)26(22,23)15-10-4-8-13-16(15)19-25-18-13/h1-4,6-8,10,14H,5,9,11H2/t14-/m0/s1