N-(methylcarbamoyl)-3-[5-(4-methylpiperazin-4-ium-1-yl)sulfonylpyridin-2-yl]sulfanyl-propanamide

Systemtic Name: N-(methylcarbamoyl)-3-[5-(4-methylpiperazin-4-ium-1-yl)sulfonylpyridin-2-yl]sulfanyl-propanamide Openeye Name: N-(methylcarbamoyl)-3-[[5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-2-pyridyl]sulfanyl]propanamide CAS Name: N-(methylcarbamoyl)-3-[[5-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]-2-pyridinyl]thio]propanamide IUPAC Name: N-(methylcarbamoyl)-3-[5-(4-methylpiperazin-4-ium-1-yl)sulfonylpyridin-2-yl]sulfanylpropanamide Traditional Name: N-(methylcarbamoyl)-3-[[5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-2-pyridyl]thio]propionamide Formula: C15H24N5O4S2+ MolecularWeight: 402.51216

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC(=O)CCSC1=NC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)C

Isomeric SMILES

CNC(=O)NC(=O)CCSC1=NC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)C

InChI

InChI=1S/C15H23N5O4S2/c1-16-15(22)18-13(21)5-10-25-14-4-3-12(11-17-14)26(23,24)20-8-6-19(2)7-9-20/h3-4,11H,5-10H2,1-2H3,(H2,16,18,21,22)/p+1