3-chloranyl-N-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]benzamide

Systemtic Name: 3-chloranyl-N-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]benzamide Openeye Name: 3-chloro-N-[2-oxo-2-[4-(p-tolylsulfonyl)piperazin-1-yl]ethyl]benzamide CAS Name: 3-chloro-N-[2-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-2-oxoethyl]benzamide IUPAC Name: 3-chloro-N-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]benzamide Traditional Name: 3-chloro-N-[2-keto-2-(4-tosylpiperazino)ethyl]benzamide Formula: C20H22ClN3O4S MolecularWeight: 435.92438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CNC(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CNC(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H22ClN3O4S/c1-15-5-7-18(8-6-15)29(27,28)24-11-9-23(10-12-24)19(25)14-22-20(26)16-3-2-4-17(21)13-16/h2-8,13H,9-12,14H2,1H3,(H,22,26)