4-(1,3-dithian-2-yl)-N-(4-methylpiperazin-4-ium-1-yl)benzamide

Systemtic Name: 4-(1,3-dithian-2-yl)-N-(4-methylpiperazin-4-ium-1-yl)benzamide Openeye Name: 4-(1,3-dithian-2-yl)-N-(4-methylpiperazin-4-ium-1-yl)benzamide CAS Name: 4-(1,3-dithian-2-yl)-N-(4-methyl-1-piperazin-4-iumyl)benzamide IUPAC Name: 4-(1,3-dithian-2-yl)-N-(4-methylpiperazin-4-ium-1-yl)benzamide Traditional Name: 4-(1,3-dithian-2-yl)-N-(4-methylpiperazin-4-ium-1-yl)benzamide Formula: C16H24N3OS2+ MolecularWeight: 338.51126

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)NC(=O)C2=CC=C(C=C2)C3SCCCS3

Isomeric SMILES

C[NH+]1CCN(CC1)NC(=O)C2=CC=C(C=C2)C3SCCCS3

InChI

InChI=1S/C16H23N3OS2/c1-18-7-9-19(10-8-18)17-15(20)13-3-5-14(6-4-13)16-21-11-2-12-22-16/h3-6,16H,2,7-12H2,1H3,(H,17,20)/p+1