2-[[4-ethyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methylpiperazin-4-ium-1-yl)ethanamide

Systemtic Name: 2-[[4-ethyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methylpiperazin-4-ium-1-yl)ethanamide Openeye Name: 2-[[4-ethyl-5-(2-furyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methylpiperazin-4-ium-1-yl)acetamide CAS Name: 2-[[4-ethyl-5-(2-furanyl)-1,2,4-triazol-3-yl]thio]-N-(4-methyl-1-piperazin-4-iumyl)acetamide IUPAC Name: 2-[[4-ethyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methylpiperazin-4-ium-1-yl)acetamide Traditional Name: 2-[[4-ethyl-5-(2-furyl)-1,2,4-triazol-3-yl]thio]-N-(4-methylpiperazin-4-ium-1-yl)acetamide Formula: C15H23N6O2S+ MolecularWeight: 351.44712

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NN2CC[NH+](CC2)C)C3=CC=CO3

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NN2CC[NH+](CC2)C)C3=CC=CO3

InChI

InChI=1S/C15H22N6O2S/c1-3-21-14(12-5-4-10-23-12)16-17-15(21)24-11-13(22)18-20-8-6-19(2)7-9-20/h4-5,10H,3,6-9,11H2,1-2H3,(H,18,22)/p+1