3-[[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]methyl]-5-methylsulfanyl-1,3,4-thiadiazole-2-thione

Systemtic Name: 3-[[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]methyl]-5-methylsulfanyl-1,3,4-thiadiazole-2-thione Openeye Name: 3-[[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]methyl]-5-methylsulfanyl-1,3,4-thiadiazole-2-thione CAS Name: 3-[[4-(2-hydroxyphenyl)-1-piperazin-1-iumyl]methyl]-5-(methylthio)-1,3,4-thiadiazole-2-thione IUPAC Name: 3-[[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]methyl]-5-methylsulfanyl-1,3,4-thiadiazole-2-thione Traditional Name: 3-[[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]methyl]-5-(methylthio)-1,3,4-thiadiazole-2-thione Formula: C14H19N4OS3+ MolecularWeight: 355.52186

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN(C(=S)S1)C[NH+]2CCN(CC2)C3=CC=CC=C3O

Isomeric SMILES

CSC1=NN(C(=S)S1)C[NH+]2CCN(CC2)C3=CC=CC=C3O

InChI

InChI=1S/C14H18N4OS3/c1-21-13-15-18(14(20)22-13)10-16-6-8-17(9-7-16)11-4-2-3-5-12(11)19/h2-5,19H,6-10H2,1H3/p+1