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

Systemtic Name: 1-[5-[4-(cyanomethyl)phenyl]thiophen-2-yl]sulfonyl-4-methylsulfonyl-N-(oxan-2-yloxy)piperazine-2-carboxamide Openeye Name: 1-[[5-[4-(cyanomethyl)phenyl]-2-thienyl]sulfonyl]-4-methylsulfonyl-N-tetrahydropyran-2-yloxy-piperazine-2-carboxamide CAS Name: 1-[[5-[4-(cyanomethyl)phenyl]-2-thiophenyl]sulfonyl]-4-methylsulfonyl-N-(2-oxanyloxy)-2-piperazinecarboxamide IUPAC Name: 1-[5-[4-(cyanomethyl)phenyl]thiophen-2-yl]sulfonyl-4-methylsulfonyl-N-(oxan-2-yloxy)piperazine-2-carboxamide Traditional Name: 1-[[5-[4-(cyanomethyl)phenyl]-2-thienyl]sulfonyl]-4-mesyl-N-tetrahydropyran-2-yloxy-piperazine-2-carboxamide Formula: C23H28N4O7S3 MolecularWeight: 568.68602

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(C(C1)C(=O)NOC2CCCCO2)S(=O)(=O)C3=CC=C(S3)C4=CC=C(C=C4)CC#N

Isomeric SMILES

CS(=O)(=O)N1CCN(C(C1)C(=O)NOC2CCCCO2)S(=O)(=O)C3=CC=C(S3)C4=CC=C(C=C4)CC#N

InChI

InChI=1S/C23H28N4O7S3/c1-36(29,30)26-13-14-27(19(16-26)23(28)25-34-21-4-2-3-15-33-21)37(31,32)22-10-9-20(35-22)18-7-5-17(6-8-18)11-12-24/h5-10,19,21H,2-4,11,13-16H2,1H3,(H,25,28)