N-(4-methylphenyl)-2-(4-methylpiperazin-4-ium-1-yl)-2-sulfanylidene-ethanamide

Systemtic Name: N-(4-methylphenyl)-2-(4-methylpiperazin-4-ium-1-yl)-2-sulfanylidene-ethanamide Openeye Name: 2-(4-methylpiperazin-4-ium-1-yl)-N-(p-tolyl)-2-thioxo-acetamide CAS Name: N-(4-methylphenyl)-2-(4-methyl-1-piperazin-4-iumyl)-2-sulfanylideneacetamide IUPAC Name: N-(4-methylphenyl)-2-(4-methylpiperazin-4-ium-1-yl)-2-sulfanylideneacetamide Traditional Name: 2-(4-methylpiperazin-4-ium-1-yl)-N-(p-tolyl)-2-thioxo-acetamide Formula: C14H20N3OS+ MolecularWeight: 278.3931

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(=S)N2CC[NH+](CC2)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C(=S)N2CC[NH+](CC2)C

InChI

InChI=1S/C14H19N3OS/c1-11-3-5-12(6-4-11)15-13(18)14(19)17-9-7-16(2)8-10-17/h3-6H,7-10H2,1-2H3,(H,15,18)/p+1