N-[2,5-bis(fluoranyl)phenyl]-2-bromanyl-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2,5-bis(fluoranyl)phenyl]-2-bromanyl-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: 2-bromo-N-(2,5-difluorophenyl)-5-(1-piperidylsulfonyl)benzamide CAS Name: 2-bromo-N-(2,5-difluorophenyl)-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: 2-bromo-N-(2,5-difluorophenyl)-5-piperidin-1-ylsulfonylbenzamide Traditional Name: 2-bromo-N-(2,5-difluorophenyl)-5-piperidinosulfonyl-benzamide Formula: C18H17BrF2N2O3S MolecularWeight: 459.304986

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)NC3=C(C=CC(=C3)F)F

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)NC3=C(C=CC(=C3)F)F

InChI

InChI=1S/C18H17BrF2N2O3S/c19-15-6-5-13(27(25,26)23-8-2-1-3-9-23)11-14(15)18(24)22-17-10-12(20)4-7-16(17)21/h4-7,10-11H,1-3,8-9H2,(H,22,24)