4-chloranyl-N-[4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-oxidanylidene-butyl]benzamide

Systemtic Name: 4-chloranyl-N-[4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-oxidanylidene-butyl]benzamide Openeye Name: 4-chloro-N-[4-oxo-4-[4-(p-tolylsulfonyl)piperazin-1-yl]butyl]benzamide CAS Name: 4-chloro-N-[4-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-4-oxobutyl]benzamide IUPAC Name: 4-chloro-N-[4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-oxobutyl]benzamide Traditional Name: 4-chloro-N-[4-keto-4-(4-tosylpiperazino)butyl]benzamide Formula: C22H26ClN3O4S MolecularWeight: 463.97754

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26ClN3O4S/c1-17-4-10-20(11-5-17)31(29,30)26-15-13-25(14-16-26)21(27)3-2-12-24-22(28)18-6-8-19(23)9-7-18/h4-11H,2-3,12-16H2,1H3,(H,24,28)