4-ethoxy-N-[1-(4-methylphenyl)sulfonyl-2-oxidanylidene-2-(4-propanoylpiperazin-1-yl)ethyl]benzamide

Systemtic Name: 4-ethoxy-N-[1-(4-methylphenyl)sulfonyl-2-oxidanylidene-2-(4-propanoylpiperazin-1-yl)ethyl]benzamide Openeye Name: 4-ethoxy-N-[2-oxo-2-(4-propanoylpiperazin-1-yl)-1-(p-tolylsulfonyl)ethyl]benzamide CAS Name: 4-ethoxy-N-[1-(4-methylphenyl)sulfonyl-2-oxo-2-[4-(1-oxopropyl)-1-piperazinyl]ethyl]benzamide IUPAC Name: 4-ethoxy-N-[1-(4-methylphenyl)sulfonyl-2-oxo-2-(4-propanoylpiperazin-1-yl)ethyl]benzamide Traditional Name: 4-ethoxy-N-[2-keto-2-(4-propionylpiperazino)-1-tosyl-ethyl]benzamide Formula: C25H31N3O6S MolecularWeight: 501.59514

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCN(CC1)C(=O)C(NC(=O)C2=CC=C(C=C2)OCC)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCC(=O)N1CCN(CC1)C(=O)C(NC(=O)C2=CC=C(C=C2)OCC)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C25H31N3O6S/c1-4-22(29)27-14-16-28(17-15-27)25(31)24(35(32,33)21-12-6-18(3)7-13-21)26-23(30)19-8-10-20(11-9-19)34-5-2/h6-13,24H,4-5,14-17H2,1-3H3,(H,26,30)