3-(azepan-1-ylsulfonyl)-N-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-4-methoxy-N-methyl-benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-4-methoxy-N-methyl-benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-[(2-chloro-6-fluoro-phenyl)methyl]-4-methoxy-N-methyl-benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-[(2-chloro-6-fluorophenyl)methyl]-4-methoxy-N-methylbenzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-[(2-chloro-6-fluorophenyl)methyl]-4-methoxy-N-methylbenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-(2-chloro-6-fluoro-benzyl)-4-methoxy-N-methyl-benzamide Formula: C22H26ClFN2O4S MolecularWeight: 468.969243

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC=C1Cl)F)C(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CN(CC1=C(C=CC=C1Cl)F)C(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C22H26ClFN2O4S/c1-25(15-17-18(23)8-7-9-19(17)24)22(27)16-10-11-20(30-2)21(14-16)31(28,29)26-12-5-3-4-6-13-26/h7-11,14H,3-6,12-13,15H2,1-2H3