3-(azepan-1-ylsulfonyl)-N-[3,5-bis(chloranyl)phenyl]-4-fluoranyl-benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-[3,5-bis(chloranyl)phenyl]-4-fluoranyl-benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-(3,5-dichlorophenyl)-4-fluoro-benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-(3,5-dichlorophenyl)-4-fluorobenzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-(3,5-dichlorophenyl)-4-fluorobenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-(3,5-dichlorophenyl)-4-fluoro-benzamide Formula: C19H19Cl2FN2O3S MolecularWeight: 445.335163

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC(=CC(=C3)Cl)Cl)F

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC(=CC(=C3)Cl)Cl)F

InChI

InChI=1S/C19H19Cl2FN2O3S/c20-14-10-15(21)12-16(11-14)23-19(25)13-5-6-17(22)18(9-13)28(26,27)24-7-3-1-2-4-8-24/h5-6,9-12H,1-4,7-8H2,(H,23,25)