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

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-(2-chloranyl-6-fluoranyl-phenyl)ethanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-(2-chloro-6-fluoro-phenyl)acetamide CAS Name: N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-2-(2-chloro-6-fluorophenyl)acetamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-2-(2-chloro-6-fluorophenyl)acetamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-(2-chloro-6-fluoro-phenyl)acetamide Formula: C21H24ClFN2O3S MolecularWeight: 438.943263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CC2=C(C=CC=C2Cl)F)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CC2=C(C=CC=C2Cl)F)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C21H24ClFN2O3S/c1-15-9-10-16(24-21(26)14-17-18(22)7-6-8-19(17)23)13-20(15)29(27,28)25-11-4-2-3-5-12-25/h6-10,13H,2-5,11-12,14H2,1H3,(H,24,26)