N-(2-chloranyl-5-methylsulfonyl-phenyl)-2-[4-(4-ethanoylphenyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(2-chloranyl-5-methylsulfonyl-phenyl)-2-[4-(4-ethanoylphenyl)piperazin-1-yl]ethanamide Openeye Name: 2-[4-(4-acetylphenyl)piperazin-1-yl]-N-(2-chloro-5-methylsulfonyl-phenyl)acetamide CAS Name: 2-[4-(4-acetylphenyl)-1-piperazinyl]-N-(2-chloro-5-methylsulfonylphenyl)acetamide IUPAC Name: 2-[4-(4-acetylphenyl)piperazin-1-yl]-N-(2-chloro-5-methylsulfonylphenyl)acetamide Traditional Name: 2-[4-(4-acetylphenyl)piperazino]-N-(2-chloro-5-mesyl-phenyl)acetamide Formula: C21H24ClN3O4S MolecularWeight: 449.95096

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)CC(=O)NC3=C(C=CC(=C3)S(=O)(=O)C)Cl

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)CC(=O)NC3=C(C=CC(=C3)S(=O)(=O)C)Cl

InChI

InChI=1S/C21H24ClN3O4S/c1-15(26)16-3-5-17(6-4-16)25-11-9-24(10-12-25)14-21(27)23-20-13-18(30(2,28)29)7-8-19(20)22/h3-8,13H,9-12,14H2,1-2H3,(H,23,27)