N,N-dimethyl-2-[2-oxidanylidene-2-(5-pyrrolidin-1-ylcarbonyl-1H-pyrrol-3-yl)ethyl]sulfanyl-1,3-benzoxazole-5-sulfonamide

Systemtic Name: N,N-dimethyl-2-[2-oxidanylidene-2-(5-pyrrolidin-1-ylcarbonyl-1H-pyrrol-3-yl)ethyl]sulfanyl-1,3-benzoxazole-5-sulfonamide Openeye Name: N,N-dimethyl-2-[2-oxo-2-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]ethyl]sulfanyl-1,3-benzoxazole-5-sulfonamide CAS Name: N,N-dimethyl-2-[[2-oxo-2-[5-[oxo(1-pyrrolidinyl)methyl]-1H-pyrrol-3-yl]ethyl]thio]-1,3-benzoxazole-5-sulfonamide IUPAC Name: N,N-dimethyl-2-[2-oxo-2-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]ethyl]sulfanyl-1,3-benzoxazole-5-sulfonamide Traditional Name: 2-[[2-keto-2-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]ethyl]thio]-N,N-dimethyl-1,3-benzoxazole-5-sulfonamide Formula: C20H22N4O5S2 MolecularWeight: 462.54248

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC2=C(C=C1)OC(=N2)SCC(=O)C3=CNC(=C3)C(=O)N4CCCC4

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC2=C(C=C1)OC(=N2)SCC(=O)C3=CNC(=C3)C(=O)N4CCCC4

InChI

InChI=1S/C20H22N4O5S2/c1-23(2)31(27,28)14-5-6-18-15(10-14)22-20(29-18)30-12-17(25)13-9-16(21-11-13)19(26)24-7-3-4-8-24/h5-6,9-11,21H,3-4,7-8,12H2,1-2H3