N-(3,4-dichlorophenyl)-2-[(4-methylpiperazin-4-ium-1-yl)amino]-2-sulfanylidene-ethanamide

Systemtic Name: N-(3,4-dichlorophenyl)-2-[(4-methylpiperazin-4-ium-1-yl)amino]-2-sulfanylidene-ethanamide Openeye Name: N-(3,4-dichlorophenyl)-2-[(4-methylpiperazin-4-ium-1-yl)amino]-2-thioxo-acetamide CAS Name: N-(3,4-dichlorophenyl)-2-[(4-methyl-1-piperazin-4-iumyl)amino]-2-sulfanylideneacetamide IUPAC Name: N-(3,4-dichlorophenyl)-2-[(4-methylpiperazin-4-ium-1-yl)amino]-2-sulfanylideneacetamide Traditional Name: N-(3,4-dichlorophenyl)-2-[(4-methylpiperazin-4-ium-1-yl)amino]-2-thioxo-acetamide Formula: C13H17Cl2N4OS+ MolecularWeight: 348.27128

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)NC(=S)C(=O)NC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

C[NH+]1CCN(CC1)NC(=S)C(=O)NC2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C13H16Cl2N4OS/c1-18-4-6-19(7-5-18)17-13(21)12(20)16-9-2-3-10(14)11(15)8-9/h2-3,8H,4-7H2,1H3,(H,16,20)(H,17,21)/p+1