propyl 3-[(4-methylphenyl)sulfonylcarbamoylamino]benzenesulfonate

Systemtic Name: propyl 3-[(4-methylphenyl)sulfonylcarbamoylamino]benzenesulfonate Openeye Name: propyl 3-(p-tolylsulfonylcarbamoylamino)benzenesulfonate CAS Name: 3-[[[(4-methylphenyl)sulfonylamino]-oxomethyl]amino]benzenesulfonic acid propyl ester IUPAC Name: propyl 3-[(4-methylphenyl)sulfonylcarbamoylamino]benzenesulfonate Traditional Name: 3-(tosylcarbamoylamino)benzenesulfonic acid propyl ester Formula: C17H20N2O6S2 MolecularWeight: 412.4805

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Descriptors Computed from Structure

Canonical SMILES:

CCCOS(=O)(=O)C1=CC=CC(=C1)NC(=O)NS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCOS(=O)(=O)C1=CC=CC(=C1)NC(=O)NS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C17H20N2O6S2/c1-3-11-25-27(23,24)16-6-4-5-14(12-16)18-17(20)19-26(21,22)15-9-7-13(2)8-10-15/h4-10,12H,3,11H2,1-2H3,(H2,18,19,20)