1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(3,5-dimethylphenyl)pyrrolidine-2-carboxamide

Systemtic Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(3,5-dimethylphenyl)pyrrolidine-2-carboxamide Openeye Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(3,5-dimethylphenyl)pyrrolidine-2-carboxamide CAS Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(3,5-dimethylphenyl)-2-pyrrolidinecarboxamide IUPAC Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(3,5-dimethylphenyl)pyrrolidine-2-carboxamide Traditional Name: N-(3,5-dimethylphenyl)-1-piazthiol-4-ylsulfonyl-pyrrolidine-2-carboxamide Formula: C19H20N4O3S2 MolecularWeight: 416.5171

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)C2CCCN2S(=O)(=O)C3=CC=CC4=NSN=C43)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)C2CCCN2S(=O)(=O)C3=CC=CC4=NSN=C43)C

InChI

InChI=1S/C19H20N4O3S2/c1-12-9-13(2)11-14(10-12)20-19(24)16-6-4-8-23(16)28(25,26)17-7-3-5-15-18(17)22-27-21-15/h3,5,7,9-11,16H,4,6,8H2,1-2H3,(H,20,24)