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

Systemtic Name: 5-(azepan-1-ylsulfonyl)-2-methyl-N-[2,4,5-tris(chloranyl)phenyl]benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-2-methyl-N-(2,4,5-trichlorophenyl)benzamide CAS Name: 5-(1-azepanylsulfonyl)-2-methyl-N-(2,4,5-trichlorophenyl)benzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-2-methyl-N-(2,4,5-trichlorophenyl)benzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-2-methyl-N-(2,4,5-trichlorophenyl)benzamide Formula: C20H21Cl3N2O3S MolecularWeight: 475.81634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)NC3=CC(=C(C=C3Cl)Cl)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)NC3=CC(=C(C=C3Cl)Cl)Cl

InChI

InChI=1S/C20H21Cl3N2O3S/c1-13-6-7-14(29(27,28)25-8-4-2-3-5-9-25)10-15(13)20(26)24-19-12-17(22)16(21)11-18(19)23/h6-7,10-12H,2-5,8-9H2,1H3,(H,24,26)