N-[[2,4-bis(fluoranyl)phenyl]methyl]-4-chloranyl-N-methyl-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[[2,4-bis(fluoranyl)phenyl]methyl]-4-chloranyl-N-methyl-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: 4-chloro-N-[(2,4-difluorophenyl)methyl]-N-methyl-3-(1-piperidylsulfonyl)benzamide CAS Name: 4-chloro-N-[(2,4-difluorophenyl)methyl]-N-methyl-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: 4-chloro-N-[(2,4-difluorophenyl)methyl]-N-methyl-3-piperidin-1-ylsulfonylbenzamide Traditional Name: 4-chloro-N-(2,4-difluorobenzyl)-N-methyl-3-piperidinosulfonyl-benzamide Formula: C20H21ClF2N2O3S MolecularWeight: 442.907146

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=C(C=C1)F)F)C(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CN(CC1=C(C=C(C=C1)F)F)C(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H21ClF2N2O3S/c1-24(13-15-5-7-16(22)12-18(15)23)20(26)14-6-8-17(21)19(11-14)29(27,28)25-9-3-2-4-10-25/h5-8,11-12H,2-4,9-10,13H2,1H3