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

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-ethyl-N-[(3-fluorophenyl)methyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-ethyl-N-[(3-fluorophenyl)methyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-ethyl-N-[(3-fluorophenyl)methyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-ethyl-N-[(3-fluorophenyl)methyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-ethyl-N-(3-fluorobenzyl)benzamide Formula: C22H26ClFN2O3S MolecularWeight: 452.969843

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26ClFN2O3S/c1-2-25(16-17-8-7-9-19(24)14-17)22(27)18-10-11-20(23)21(15-18)30(28,29)26-12-5-3-4-6-13-26/h7-11,14-15H,2-6,12-13,16H2,1H3