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

Systemtic Name: 2-chloranyl-5-methylsulfonyl-N-[4-[[4-(phenylmethyl)piperazin-1-yl]methyl]phenyl]benzamide Openeye Name: N-[4-[(4-benzylpiperazin-1-yl)methyl]phenyl]-2-chloro-5-methylsulfonyl-benzamide CAS Name: 2-chloro-5-methylsulfonyl-N-[4-[[4-(phenylmethyl)-1-piperazinyl]methyl]phenyl]benzamide IUPAC Name: N-[4-[(4-benzylpiperazin-1-yl)methyl]phenyl]-2-chloro-5-methylsulfonylbenzamide Traditional Name: N-[4-[(4-benzylpiperazino)methyl]phenyl]-2-chloro-5-mesyl-benzamide Formula: C26H28ClN3O3S MolecularWeight: 498.03682

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)NC2=CC=C(C=C2)CN3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)NC2=CC=C(C=C2)CN3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C26H28ClN3O3S/c1-34(32,33)23-11-12-25(27)24(17-23)26(31)28-22-9-7-21(8-10-22)19-30-15-13-29(14-16-30)18-20-5-3-2-4-6-20/h2-12,17H,13-16,18-19H2,1H3,(H,28,31)