N-(2,3-dimethylphenyl)-2-(4-methylpiperazin-4-ium-1-yl)-2-sulfanylidene-ethanamide

Systemtic Name: N-(2,3-dimethylphenyl)-2-(4-methylpiperazin-4-ium-1-yl)-2-sulfanylidene-ethanamide Openeye Name: N-(2,3-dimethylphenyl)-2-(4-methylpiperazin-4-ium-1-yl)-2-thioxo-acetamide CAS Name: N-(2,3-dimethylphenyl)-2-(4-methyl-1-piperazin-4-iumyl)-2-sulfanylideneacetamide IUPAC Name: N-(2,3-dimethylphenyl)-2-(4-methylpiperazin-4-ium-1-yl)-2-sulfanylideneacetamide Traditional Name: N-(2,3-dimethylphenyl)-2-(4-methylpiperazin-4-ium-1-yl)-2-thioxo-acetamide Formula: C15H22N3OS+ MolecularWeight: 292.41968

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21N3OS/c1-11-5-4-6-13(12(11)2)16-14(19)15(20)18-9-7-17(3)8-10-18/h4-6H,7-10H2,1-3H3,(H,16,19)/p+1