N-[1-(2,4-dichlorophenyl)ethyl]-4-(4-ethanoylpiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[1-(2,4-dichlorophenyl)ethyl]-4-(4-ethanoylpiperazin-1-yl)sulfonyl-benzamide Openeye Name: 4-(4-acetylpiperazin-1-yl)sulfonyl-N-[1-(2,4-dichlorophenyl)ethyl]benzamide CAS Name: 4-[(4-acetyl-1-piperazinyl)sulfonyl]-N-[1-(2,4-dichlorophenyl)ethyl]benzamide IUPAC Name: 4-(4-acetylpiperazin-1-yl)sulfonyl-N-[1-(2,4-dichlorophenyl)ethyl]benzamide Traditional Name: 4-(4-acetylpiperazino)sulfonyl-N-[1-(2,4-dichlorophenyl)ethyl]benzamide Formula: C21H23Cl2N3O4S MolecularWeight: 484.39602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=C(C=C1)Cl)Cl)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)C

Isomeric SMILES

CC(C1=C(C=C(C=C1)Cl)Cl)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)C

InChI

InChI=1S/C21H23Cl2N3O4S/c1-14(19-8-5-17(22)13-20(19)23)24-21(28)16-3-6-18(7-4-16)31(29,30)26-11-9-25(10-12-26)15(2)27/h3-8,13-14H,9-12H2,1-2H3,(H,24,28)