[2-(2-morpholin-4-ylethylcarbamoylamino)-3H-benzimidazol-5-yl] 2,6-bis(chloranyl)benzenesulfonate

Systemtic Name: [2-(2-morpholin-4-ylethylcarbamoylamino)-3H-benzimidazol-5-yl] 2,6-bis(chloranyl)benzenesulfonate Openeye Name: [2-(2-morpholinoethylcarbamoylamino)-3H-benzimidazol-5-yl] 2,6-dichlorobenzenesulfonate CAS Name: 2,6-dichlorobenzenesulfonic acid [2-[[[2-(4-morpholinyl)ethylamino]-oxomethyl]amino]-3H-benzimidazol-5-yl] ester IUPAC Name: [2-(2-morpholin-4-ylethylcarbamoylamino)-3H-benzimidazol-5-yl] 2,6-dichlorobenzenesulfonate Traditional Name: 2,6-dichlorobenzenesulfonic acid [2-(2-morpholinoethylcarbamoylamino)-3H-benzimidazol-5-yl] ester Formula: C20H21Cl2N5O5S MolecularWeight: 514.38224

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCNC(=O)NC2=NC3=C(N2)C=C(C=C3)OS(=O)(=O)C4=C(C=CC=C4Cl)Cl

Isomeric SMILES

C1COCCN1CCNC(=O)NC2=NC3=C(N2)C=C(C=C3)OS(=O)(=O)C4=C(C=CC=C4Cl)Cl

InChI

InChI=1S/C20H21Cl2N5O5S/c21-14-2-1-3-15(22)18(14)33(29,30)32-13-4-5-16-17(12-13)25-19(24-16)26-20(28)23-6-7-27-8-10-31-11-9-27/h1-5,12H,6-11H2,(H3,23,24,25,26,28)