N-(4-methylpiperazin-4-ium-1-yl)-4-methylsulfanyl-benzamide

Systemtic Name: N-(4-methylpiperazin-4-ium-1-yl)-4-methylsulfanyl-benzamide Openeye Name: N-(4-methylpiperazin-4-ium-1-yl)-4-methylsulfanyl-benzamide CAS Name: N-(4-methyl-1-piperazin-4-iumyl)-4-(methylthio)benzamide IUPAC Name: N-(4-methylpiperazin-4-ium-1-yl)-4-methylsulfanylbenzamide Traditional Name: N-(4-methylpiperazin-4-ium-1-yl)-4-(methylthio)benzamide Formula: C13H20N3OS+ MolecularWeight: 266.3824

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19N3OS/c1-15-7-9-16(10-8-15)14-13(17)11-3-5-12(18-2)6-4-11/h3-6H,7-10H2,1-2H3,(H,14,17)/p+1