4-[7-[(3-chlorophenyl)carbonylamino]dibenzofuran-2-yl]sulfonyl-2,2-dimethyl-thiomorpholine-3-carboxylic acid

Systemtic Name: 4-[7-[(3-chlorophenyl)carbonylamino]dibenzofuran-2-yl]sulfonyl-2,2-dimethyl-thiomorpholine-3-carboxylic acid Openeye Name: 4-[7-[(3-chlorobenzoyl)amino]dibenzofuran-2-yl]sulfonyl-2,2-dimethyl-thiomorpholine-3-carboxylic acid CAS Name: 4-[[7-[[(3-chlorophenyl)-oxomethyl]amino]-2-dibenzofuranyl]sulfonyl]-2,2-dimethyl-3-thiomorpholinecarboxylic acid IUPAC Name: 4-[7-[(3-chlorobenzoyl)amino]dibenzofuran-2-yl]sulfonyl-2,2-dimethylthiomorpholine-3-carboxylic acid Traditional Name: 4-[7-[(3-chlorobenzoyl)amino]dibenzofuran-2-yl]sulfonyl-2,2-dimethyl-thiomorpholine-3-carboxylic acid Formula: C26H23ClN2O6S2 MolecularWeight: 559.05362

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N(CCS1)S(=O)(=O)C2=CC3=C(C=C2)OC4=C3C=CC(=C4)NC(=O)C5=CC(=CC=C5)Cl)C(=O)O)C

Isomeric SMILES

CC1(C(N(CCS1)S(=O)(=O)C2=CC3=C(C=C2)OC4=C3C=CC(=C4)NC(=O)C5=CC(=CC=C5)Cl)C(=O)O)C

InChI

InChI=1S/C26H23ClN2O6S2/c1-26(2)23(25(31)32)29(10-11-36-26)37(33,34)18-7-9-21-20(14-18)19-8-6-17(13-22(19)35-21)28-24(30)15-4-3-5-16(27)12-15/h3-9,12-14,23H,10-11H2,1-2H3,(H,28,30)(H,31,32)