3-(azepan-1-ylsulfonyl)-N-[(4-fluorophenyl)methyl]-N-methyl-benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-[(4-fluorophenyl)methyl]-N-methyl-benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-[(4-fluorophenyl)methyl]-N-methyl-benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-[(4-fluorophenyl)methyl]-N-methylbenzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-[(4-fluorophenyl)methyl]-N-methylbenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-(4-fluorobenzyl)-N-methyl-benzamide Formula: C21H25FN2O3S MolecularWeight: 404.498203

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)F)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CN(CC1=CC=C(C=C1)F)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C21H25FN2O3S/c1-23(16-17-9-11-19(22)12-10-17)21(25)18-7-6-8-20(15-18)28(26,27)24-13-4-2-3-5-14-24/h6-12,15H,2-5,13-14,16H2,1H3