N-(1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ium-4-ylpropyl)-1-benzofuran-2-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ium-4-ylpropyl)-1-benzofuran-2-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ium-4-ylpropyl)benzofuran-2-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-[3-(4-morpholin-4-iumyl)propyl]-2-benzofurancarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ium-4-ylpropyl)-1-benzofuran-2-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ium-4-ylpropyl)coumarilamide Formula: C23H24N3O3S+ MolecularWeight: 422.51996

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCN(C2=NC3=CC=CC=C3S2)C(=O)C4=CC5=CC=CC=C5O4

Isomeric SMILES

C1COCC[NH+]1CCCN(C2=NC3=CC=CC=C3S2)C(=O)C4=CC5=CC=CC=C5O4

InChI

InChI=1S/C23H23N3O3S/c27-22(20-16-17-6-1-3-8-19(17)29-20)26(11-5-10-25-12-14-28-15-13-25)23-24-18-7-2-4-9-21(18)30-23/h1-4,6-9,16H,5,10-15H2/p+1