5-(azepan-1-ylsulfonyl)-2-fluoranyl-N-(4-propan-2-ylphenyl)benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-2-fluoranyl-N-(4-propan-2-ylphenyl)benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-2-fluoro-N-(4-isopropylphenyl)benzamide CAS Name: 5-(1-azepanylsulfonyl)-2-fluoro-N-(4-propan-2-ylphenyl)benzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-2-fluoro-N-(4-propan-2-ylphenyl)benzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-2-fluoro-N-p-cumenyl-benzamide Formula: C22H27FN2O3S MolecularWeight: 418.524783

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27FN2O3S/c1-16(2)17-7-9-18(10-8-17)24-22(26)20-15-19(11-12-21(20)23)29(27,28)25-13-5-3-4-6-14-25/h7-12,15-16H,3-6,13-14H2,1-2H3,(H,24,26)