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

Systemtic Name: 3-[[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-5-(methylamino)-1,3,4-thiadiazole-2-thione Openeye Name: 3-[[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-5-(methylamino)-1,3,4-thiadiazole-2-thione CAS Name: 3-[[4-(4-methoxyphenyl)-1-piperazin-1-iumyl]methyl]-5-(methylamino)-1,3,4-thiadiazole-2-thione IUPAC Name: 3-[[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-5-(methylamino)-1,3,4-thiadiazole-2-thione Traditional Name: 3-[[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-5-(methylamino)-1,3,4-thiadiazole-2-thione Formula: C15H22N5OS2+ MolecularWeight: 352.49808

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NN(C(=S)S1)C[NH+]2CCN(CC2)C3=CC=C(C=C3)OC

Isomeric SMILES

CNC1=NN(C(=S)S1)C[NH+]2CCN(CC2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C15H21N5OS2/c1-16-14-17-20(15(22)23-14)11-18-7-9-19(10-8-18)12-3-5-13(21-2)6-4-12/h3-6H,7-11H2,1-2H3,(H,16,17)/p+1