4-(1,3-dithiolan-2-yl)-N-(6-morpholin-4-ylpyridin-1-ium-3-yl)benzamide

Systemtic Name: 4-(1,3-dithiolan-2-yl)-N-(6-morpholin-4-ylpyridin-1-ium-3-yl)benzamide Openeye Name: 4-(1,3-dithiolan-2-yl)-N-(6-morpholinopyridin-1-ium-3-yl)benzamide CAS Name: 4-(1,3-dithiolan-2-yl)-N-[6-(4-morpholinyl)-3-pyridin-1-iumyl]benzamide IUPAC Name: 4-(1,3-dithiolan-2-yl)-N-(6-morpholin-4-ylpyridin-1-ium-3-yl)benzamide Traditional Name: 4-(1,3-dithiolan-2-yl)-N-(6-morpholinopyridin-1-ium-3-yl)benzamide Formula: C19H22N3O2S2+ MolecularWeight: 388.52688

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=[NH+]C=C(C=C2)NC(=O)C3=CC=C(C=C3)C4SCCS4

Isomeric SMILES

C1COCCN1C2=[NH+]C=C(C=C2)NC(=O)C3=CC=C(C=C3)C4SCCS4

InChI

InChI=1S/C19H21N3O2S2/c23-18(14-1-3-15(4-2-14)19-25-11-12-26-19)21-16-5-6-17(20-13-16)22-7-9-24-10-8-22/h1-6,13,19H,7-12H2,(H,21,23)/p+1