cyclohexyl 3-[3-[(4-methylphenyl)sulfonylcarbamoyl]-1,2,4-oxadiazol-5-yl]hexanoate

Systemtic Name: cyclohexyl 3-[3-[(4-methylphenyl)sulfonylcarbamoyl]-1,2,4-oxadiazol-5-yl]hexanoate Openeye Name: cyclohexyl 3-[3-(p-tolylsulfonylcarbamoyl)-1,2,4-oxadiazol-5-yl]hexanoate CAS Name: 3-[3-[[(4-methylphenyl)sulfonylamino]-oxomethyl]-1,2,4-oxadiazol-5-yl]hexanoic acid cyclohexyl ester IUPAC Name: cyclohexyl 3-[3-[(4-methylphenyl)sulfonylcarbamoyl]-1,2,4-oxadiazol-5-yl]hexanoate Traditional Name: 3-[3-(tosylcarbamoyl)-1,2,4-oxadiazol-5-yl]hexanoic acid cyclohexyl ester Formula: C22H29N3O6S MolecularWeight: 463.54716

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC(=O)OC1CCCCC1)C2=NC(=NO2)C(=O)NS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCC(CC(=O)OC1CCCCC1)C2=NC(=NO2)C(=O)NS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H29N3O6S/c1-3-7-16(14-19(26)30-17-8-5-4-6-9-17)22-23-20(24-31-22)21(27)25-32(28,29)18-12-10-15(2)11-13-18/h10-13,16-17H,3-9,14H2,1-2H3,(H,25,27)