N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-4-(trifluoromethyl)benzamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-4-(trifluoromethyl)benzamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-4-(trifluoromethyl)benzamide CAS Name: N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-4-(trifluoromethyl)benzamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-4-(trifluoromethyl)benzamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-4-(trifluoromethyl)benzamide Formula: C21H23F3N2O3S MolecularWeight: 440.47913

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23F3N2O3S/c1-15-6-11-18(14-19(15)30(28,29)26-12-4-2-3-5-13-26)25-20(27)16-7-9-17(10-8-16)21(22,23)24/h6-11,14H,2-5,12-13H2,1H3,(H,25,27)