4-(azepan-1-ylsulfonyl)-N-[(2-fluorophenyl)methyl]-N-methyl-benzamide

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N-[(2-fluorophenyl)methyl]-N-methyl-benzamide Openeye Name: 4-(azepan-1-ylsulfonyl)-N-[(2-fluorophenyl)methyl]-N-methyl-benzamide CAS Name: 4-(1-azepanylsulfonyl)-N-[(2-fluorophenyl)methyl]-N-methylbenzamide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N-[(2-fluorophenyl)methyl]-N-methylbenzamide Traditional Name: 4-(azepan-1-ylsulfonyl)-N-(2-fluorobenzyl)-N-methyl-benzamide Formula: C21H25FN2O3S MolecularWeight: 404.498203

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1F)C(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CN(CC1=CC=CC=C1F)C(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C21H25FN2O3S/c1-23(16-18-8-4-5-9-20(18)22)21(25)17-10-12-19(13-11-17)28(26,27)24-14-6-2-3-7-15-24/h4-5,8-13H,2-3,6-7,14-16H2,1H3