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

Systemtic Name: N-(2-chloranyl-5-methylsulfonyl-phenyl)-2-[4-(phenylmethyl)piperazin-1-yl]ethanamide Openeye Name: 2-(4-benzylpiperazin-1-yl)-N-(2-chloro-5-methylsulfonyl-phenyl)acetamide CAS Name: N-(2-chloro-5-methylsulfonylphenyl)-2-[4-(phenylmethyl)-1-piperazinyl]acetamide IUPAC Name: 2-(4-benzylpiperazin-1-yl)-N-(2-chloro-5-methylsulfonylphenyl)acetamide Traditional Name: 2-(4-benzylpiperazino)-N-(2-chloro-5-mesyl-phenyl)acetamide Formula: C20H24ClN3O3S MolecularWeight: 421.94086

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)Cl)NC(=O)CN2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)Cl)NC(=O)CN2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C20H24ClN3O3S/c1-28(26,27)17-7-8-18(21)19(13-17)22-20(25)15-24-11-9-23(10-12-24)14-16-5-3-2-4-6-16/h2-8,13H,9-12,14-15H2,1H3,(H,22,25)