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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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