3-(azepan-1-ylsulfonyl)-N-(4-ethylphenyl)-4-fluoranyl-benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-(4-ethylphenyl)-4-fluoranyl-benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-(4-ethylphenyl)-4-fluoro-benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-(4-ethylphenyl)-4-fluorobenzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-(4-ethylphenyl)-4-fluorobenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-(4-ethylphenyl)-4-fluoro-benzamide Formula: C21H25FN2O3S MolecularWeight: 404.498203

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C21H25FN2O3S/c1-2-16-7-10-18(11-8-16)23-21(25)17-9-12-19(22)20(15-17)28(26,27)24-13-5-3-4-6-14-24/h7-12,15H,2-6,13-14H2,1H3,(H,23,25)