[4-[5-[4-methylsulfonyl-2-(oxidanylcarbamoyl)piperazin-1-yl]sulfonylthiophen-2-yl]phenyl]methyl ethanoate

Systemtic Name: [4-[5-[4-methylsulfonyl-2-(oxidanylcarbamoyl)piperazin-1-yl]sulfonylthiophen-2-yl]phenyl]methyl ethanoate Openeye Name: [4-[5-[2-(hydroxycarbamoyl)-4-methylsulfonyl-piperazin-1-yl]sulfonyl-2-thienyl]phenyl]methyl acetate CAS Name: acetic acid [4-[5-[[2-[(hydroxyamino)-oxomethyl]-4-methylsulfonyl-1-piperazinyl]sulfonyl]-2-thiophenyl]phenyl]methyl ester IUPAC Name: [4-[5-[2-(hydroxycarbamoyl)-4-methylsulfonylpiperazin-1-yl]sulfonylthiophen-2-yl]phenyl]methyl acetate Traditional Name: acetic acid [4-[5-[2-(hydroxycarbamoyl)-4-mesyl-piperazino]sulfonyl-2-thienyl]benzyl] ester Formula: C19H23N3O8S3 MolecularWeight: 517.59622

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1=CC=C(C=C1)C2=CC=C(S2)S(=O)(=O)N3CCN(CC3C(=O)NO)S(=O)(=O)C

Isomeric SMILES

CC(=O)OCC1=CC=C(C=C1)C2=CC=C(S2)S(=O)(=O)N3CCN(CC3C(=O)NO)S(=O)(=O)C

InChI

InChI=1S/C19H23N3O8S3/c1-13(23)30-12-14-3-5-15(6-4-14)17-7-8-18(31-17)33(28,29)22-10-9-21(32(2,26)27)11-16(22)19(24)20-25/h3-8,16,25H,9-12H2,1-2H3,(H,20,24)