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

Systemtic Name: 3-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-5-methyl-1,3,4-thiadiazole-2-thione Openeye Name: 3-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-5-methyl-1,3,4-thiadiazole-2-thione CAS Name: 3-[[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]methyl]-5-methyl-1,3,4-thiadiazole-2-thione IUPAC Name: 3-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-5-methyl-1,3,4-thiadiazole-2-thione Traditional Name: 3-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-5-methyl-1,3,4-thiadiazole-2-thione Formula: C15H21N4OS2+ MolecularWeight: 337.48344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=S)S1)C[NH+]2CCN(CC2)C3=CC=CC=C3OC

Isomeric SMILES

CC1=NN(C(=S)S1)C[NH+]2CCN(CC2)C3=CC=CC=C3OC

InChI

InChI=1S/C15H20N4OS2/c1-12-16-19(15(21)22-12)11-17-7-9-18(10-8-17)13-5-3-4-6-14(13)20-2/h3-6H,7-11H2,1-2H3/p+1