6-dibenzothiophen-4-yl-N-(2-morpholin-4-ium-4-ylethyl)-2-morpholin-4-yl-pyridin-1-ium-3-carboxamide

Systemtic Name: 6-dibenzothiophen-4-yl-N-(2-morpholin-4-ium-4-ylethyl)-2-morpholin-4-yl-pyridin-1-ium-3-carboxamide Openeye Name: 6-dibenzothiophen-4-yl-N-(2-morpholin-4-ium-4-ylethyl)-2-morpholino-pyridin-1-ium-3-carboxamide CAS Name: 6-(4-dibenzothiophenyl)-N-[2-(4-morpholin-4-iumyl)ethyl]-2-(4-morpholinyl)-3-pyridin-1-iumcarboxamide IUPAC Name: 6-dibenzothiophen-4-yl-N-(2-morpholin-4-ium-4-ylethyl)-2-morpholin-4-ylpyridin-1-ium-3-carboxamide Traditional Name: 6-dibenzothiophen-4-yl-N-(2-morpholin-4-ium-4-ylethyl)-2-morpholino-pyridin-1-ium-3-carboxamide Formula: C28H32N4O3S+2 MolecularWeight: 504.64368

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=O)C2=C([NH+]=C(C=C2)C3=CC=CC4=C3SC5=CC=CC=C45)N6CCOCC6

Isomeric SMILES

C1COCC[NH+]1CCNC(=O)C2=C([NH+]=C(C=C2)C3=CC=CC4=C3SC5=CC=CC=C45)N6CCOCC6

InChI

InChI=1S/C28H30N4O3S/c33-28(29-10-11-31-12-16-34-17-13-31)23-8-9-24(30-27(23)32-14-18-35-19-15-32)22-6-3-5-21-20-4-1-2-7-25(20)36-26(21)22/h1-9H,10-19H2,(H,29,33)/p+2