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

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

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=S)C(=O)NCC2=CC=CC=C2

Isomeric SMILES

C[NH+]1CCN(CC1)C(=S)C(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C14H19N3OS/c1-16-7-9-17(10-8-16)14(19)13(18)15-11-12-5-3-2-4-6-12/h2-6H,7-11H2,1H3,(H,15,18)/p+1