1-[5-[4-(cyanomethyl)phenyl]thiophen-2-yl]sulfonyl-4-methylsulfonyl-N-oxidanyl-piperazine-2-carboxamide

Systemtic Name: 1-[5-[4-(cyanomethyl)phenyl]thiophen-2-yl]sulfonyl-4-methylsulfonyl-N-oxidanyl-piperazine-2-carboxamide Openeye Name: 1-[[5-[4-(cyanomethyl)phenyl]-2-thienyl]sulfonyl]-4-methylsulfonyl-piperazine-2-carbohydroxamic acid CAS Name: 1-[[5-[4-(cyanomethyl)phenyl]-2-thiophenyl]sulfonyl]-N-hydroxy-4-methylsulfonyl-2-piperazinecarboxamide IUPAC Name: 1-[5-[4-(cyanomethyl)phenyl]thiophen-2-yl]sulfonyl-N-hydroxy-4-methylsulfonylpiperazine-2-carboxamide Traditional Name: 1-[[5-[4-(cyanomethyl)phenyl]-2-thienyl]sulfonyl]-4-mesyl-piperazine-2-carbohydroxamic acid Formula: C18H20N4O6S3 MolecularWeight: 484.5696

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(C(C1)C(=O)NO)S(=O)(=O)C2=CC=C(S2)C3=CC=C(C=C3)CC#N

Isomeric SMILES

CS(=O)(=O)N1CCN(C(C1)C(=O)NO)S(=O)(=O)C2=CC=C(S2)C3=CC=C(C=C3)CC#N

InChI

InChI=1S/C18H20N4O6S3/c1-30(25,26)21-10-11-22(15(12-21)18(23)20-24)31(27,28)17-7-6-16(29-17)14-4-2-13(3-5-14)8-9-19/h2-7,15,24H,8,10-12H2,1H3,(H,20,23)