3-(azepan-1-ylsulfonyl)-N-[[3,5-bis(fluoranyl)phenyl]methyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-[[3,5-bis(fluoranyl)phenyl]methyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-[(3,5-difluorophenyl)methyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-[(3,5-difluorophenyl)methyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-[(3,5-difluorophenyl)methyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-(3,5-difluorobenzyl)benzamide Formula: C20H22F2N2O3S MolecularWeight: 408.462086

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCC3=CC(=CC(=C3)F)F

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCC3=CC(=CC(=C3)F)F

InChI

InChI=1S/C20H22F2N2O3S/c21-17-10-15(11-18(22)13-17)14-23-20(25)16-6-5-7-19(12-16)28(26,27)24-8-3-1-2-4-9-24/h5-7,10-13H,1-4,8-9,14H2,(H,23,25)