N-(2-ethoxyphenyl)-N-[2-(4-methanoylpiperazin-1-yl)-2-oxidanylidene-ethyl]-4-methylsulfanyl-benzenesulfonamide

Systemtic Name: N-(2-ethoxyphenyl)-N-[2-(4-methanoylpiperazin-1-yl)-2-oxidanylidene-ethyl]-4-methylsulfanyl-benzenesulfonamide Openeye Name: N-(2-ethoxyphenyl)-N-[2-(4-formylpiperazin-1-yl)-2-oxo-ethyl]-4-methylsulfanyl-benzenesulfonamide CAS Name: N-(2-ethoxyphenyl)-N-[2-(4-formyl-1-piperazinyl)-2-oxoethyl]-4-(methylthio)benzenesulfonamide IUPAC Name: N-(2-ethoxyphenyl)-N-[2-(4-formylpiperazin-1-yl)-2-oxoethyl]-4-methylsulfanylbenzenesulfonamide Traditional Name: N-[2-(4-formylpiperazino)-2-keto-ethyl]-4-(methylthio)-N-o-phenetyl-benzenesulfonamide Formula: C22H27N3O5S2 MolecularWeight: 477.59688

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N(CC(=O)N2CCN(CC2)C=O)S(=O)(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

CCOC1=CC=CC=C1N(CC(=O)N2CCN(CC2)C=O)S(=O)(=O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C22H27N3O5S2/c1-3-30-21-7-5-4-6-20(21)25(16-22(27)24-14-12-23(17-26)13-15-24)32(28,29)19-10-8-18(31-2)9-11-19/h4-11,17H,3,12-16H2,1-2H3