3-methyl-N-(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-2-(thiophen-2-ylsulfonylamino)butanamide

Systemtic Name: 3-methyl-N-(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-2-(thiophen-2-ylsulfonylamino)butanamide Openeye Name: N-(2-hydroxy-5-pyrrolidin-1-ylsulfonyl-phenyl)-3-methyl-2-(2-thienylsulfonylamino)butanamide CAS Name: N-[2-hydroxy-5-(1-pyrrolidinylsulfonyl)phenyl]-3-methyl-2-(thiophen-2-ylsulfonylamino)butanamide IUPAC Name: N-(2-hydroxy-5-pyrrolidin-1-ylsulfonylphenyl)-3-methyl-2-(thiophen-2-ylsulfonylamino)butanamide Traditional Name: N-(2-hydroxy-5-pyrrolidinosulfonyl-phenyl)-3-methyl-2-(2-thienylsulfonylamino)butyramide Formula: C19H25N3O6S3 MolecularWeight: 487.6133

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=C(C=CC(=C1)S(=O)(=O)N2CCCC2)O)NS(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC(C)C(C(=O)NC1=C(C=CC(=C1)S(=O)(=O)N2CCCC2)O)NS(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C19H25N3O6S3/c1-13(2)18(21-30(25,26)17-6-5-11-29-17)19(24)20-15-12-14(7-8-16(15)23)31(27,28)22-9-3-4-10-22/h5-8,11-13,18,21,23H,3-4,9-10H2,1-2H3,(H,20,24)