3-(4-methylphenyl)sulfonylpropyl 2-(cyclohexylsulfonylcarbamoylamino)benzoate

Systemtic Name: 3-(4-methylphenyl)sulfonylpropyl 2-(cyclohexylsulfonylcarbamoylamino)benzoate Openeye Name: 3-(p-tolylsulfonyl)propyl 2-(cyclohexylsulfonylcarbamoylamino)benzoate CAS Name: 2-[[(cyclohexylsulfonylamino)-oxomethyl]amino]benzoic acid 3-(4-methylphenyl)sulfonylpropyl ester IUPAC Name: 3-(4-methylphenyl)sulfonylpropyl 2-(cyclohexylsulfonylcarbamoylamino)benzoate Traditional Name: 2-(cyclohexylsulfonylcarbamoylamino)benzoic acid 3-tosylpropyl ester Formula: C24H30N2O7S2 MolecularWeight: 522.6342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCCOC(=O)C2=CC=CC=C2NC(=O)NS(=O)(=O)C3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCCOC(=O)C2=CC=CC=C2NC(=O)NS(=O)(=O)C3CCCCC3

InChI

InChI=1S/C24H30N2O7S2/c1-18-12-14-19(15-13-18)34(29,30)17-7-16-33-23(27)21-10-5-6-11-22(21)25-24(28)26-35(31,32)20-8-3-2-4-9-20/h5-6,10-15,20H,2-4,7-9,16-17H2,1H3,(H2,25,26,28)