4-methylsulfonyl-N-(oxan-2-yloxy)-1-(5-phenylthiophen-2-yl)sulfonyl-piperazine-2-carboxamide

Systemtic Name: 4-methylsulfonyl-N-(oxan-2-yloxy)-1-(5-phenylthiophen-2-yl)sulfonyl-piperazine-2-carboxamide Openeye Name: 4-methylsulfonyl-1-[(5-phenyl-2-thienyl)sulfonyl]-N-tetrahydropyran-2-yloxy-piperazine-2-carboxamide CAS Name: 4-methylsulfonyl-N-(2-oxanyloxy)-1-[(5-phenyl-2-thiophenyl)sulfonyl]-2-piperazinecarboxamide IUPAC Name: 4-methylsulfonyl-N-(oxan-2-yloxy)-1-(5-phenylthiophen-2-yl)sulfonylpiperazine-2-carboxamide Traditional Name: 4-mesyl-1-[(5-phenyl-2-thienyl)sulfonyl]-N-tetrahydropyran-2-yloxy-piperazine-2-carboxamide Formula: C21H27N3O7S3 MolecularWeight: 529.64998

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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=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O7S3/c1-33(26,27)23-12-13-24(17(15-23)21(25)22-31-19-9-5-6-14-30-19)34(28,29)20-11-10-18(32-20)16-7-3-2-4-8-16/h2-4,7-8,10-11,17,19H,5-6,9,12-15H2,1H3,(H,22,25)