N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-chloranyl-4,5-bis(fluoranyl)benzamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-chloranyl-4,5-bis(fluoranyl)benzamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-chloro-4,5-difluoro-benzamide CAS Name: N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-2-chloro-4,5-difluorobenzamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-2-chloro-4,5-difluorobenzamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-chloro-4,5-difluoro-benzamide Formula: C20H21ClF2N2O3S MolecularWeight: 442.907146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2Cl)F)F)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2Cl)F)F)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C20H21ClF2N2O3S/c1-13-6-7-14(24-20(26)15-11-17(22)18(23)12-16(15)21)10-19(13)29(27,28)25-8-4-2-3-5-9-25/h6-7,10-12H,2-5,8-9H2,1H3,(H,24,26)