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

Systemtic Name: N-[1-(4-methylphenyl)sulfonyl-2-oxidanylidene-2-(4-propanoylpiperazin-1-yl)ethyl]benzamide Openeye Name: N-[2-oxo-2-(4-propanoylpiperazin-1-yl)-1-(p-tolylsulfonyl)ethyl]benzamide CAS Name: N-[1-(4-methylphenyl)sulfonyl-2-oxo-2-[4-(1-oxopropyl)-1-piperazinyl]ethyl]benzamide IUPAC Name: N-[1-(4-methylphenyl)sulfonyl-2-oxo-2-(4-propanoylpiperazin-1-yl)ethyl]benzamide Traditional Name: N-[2-keto-2-(4-propionylpiperazino)-1-tosyl-ethyl]benzamide Formula: C23H27N3O5S MolecularWeight: 457.54258

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N3O5S/c1-3-20(27)25-13-15-26(16-14-25)23(29)22(24-21(28)18-7-5-4-6-8-18)32(30,31)19-11-9-17(2)10-12-19/h4-12,22H,3,13-16H2,1-2H3,(H,24,28)