4-ethyl-3-[2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]ethyl]-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-ethyl-3-[2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]ethyl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-ethyl-3-[2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]ethyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-ethyl-3-[2-[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]ethyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-ethyl-3-[2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]ethyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-ethyl-3-[2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]ethyl]-1H-1,2,4-triazole-5-thione Formula: C17H26N5OS+ MolecularWeight: 348.48624

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NNC1=S)CC[NH+]2CCN(CC2)C3=CC=CC=C3OC

Isomeric SMILES

CCN1C(=NNC1=S)CC[NH+]2CCN(CC2)C3=CC=CC=C3OC

InChI

InChI=1S/C17H25N5OS/c1-3-22-16(18-19-17(22)24)8-9-20-10-12-21(13-11-20)14-6-4-5-7-15(14)23-2/h4-7H,3,8-13H2,1-2H3,(H,19,24)/p+1