N-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-methyl-3-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-benzamide

Systemtic Name: N-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-methyl-3-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-benzamide Openeye Name: 3-(4-benzylpiperazin-1-yl)sulfonyl-N-[(2-chloro-6-fluoro-phenyl)methyl]-N-methyl-benzamide CAS Name: N-[(2-chloro-6-fluorophenyl)methyl]-N-methyl-3-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]benzamide IUPAC Name: 3-(4-benzylpiperazin-1-yl)sulfonyl-N-[(2-chloro-6-fluorophenyl)methyl]-N-methylbenzamide Traditional Name: 3-(4-benzylpiperazino)sulfonyl-N-(2-chloro-6-fluoro-benzyl)-N-methyl-benzamide Formula: C26H27ClFN3O3S MolecularWeight: 516.027283

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC=C1Cl)F)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CN(CC1=C(C=CC=C1Cl)F)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C26H27ClFN3O3S/c1-29(19-23-24(27)11-6-12-25(23)28)26(32)21-9-5-10-22(17-21)35(33,34)31-15-13-30(14-16-31)18-20-7-3-2-4-8-20/h2-12,17H,13-16,18-19H2,1H3