4-chloranyl-N-[3-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-3-oxidanylidene-propyl]benzamide

Systemtic Name: 4-chloranyl-N-[3-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-3-oxidanylidene-propyl]benzamide Openeye Name: 4-chloro-N-[3-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-3-oxo-propyl]benzamide CAS Name: 4-chloro-N-[3-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]-3-oxopropyl]benzamide IUPAC Name: 4-chloro-N-[3-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-3-oxopropyl]benzamide Traditional Name: 4-chloro-N-[3-[4-(2,4-dimethylphenyl)sulfonylpiperazino]-3-keto-propyl]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)CCNC(=O)C3=CC=C(C=C3)Cl)C

Isomeric SMILES

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

InChI

InChI=1S/C22H26ClN3O4S/c1-16-3-8-20(17(2)15-16)31(29,30)26-13-11-25(12-14-26)21(27)9-10-24-22(28)18-4-6-19(23)7-5-18/h3-8,15H,9-14H2,1-2H3,(H,24,28)