5-methyl-3-[(4-phenylpiperazin-1-ium-1-yl)methyl]-1,3,4-oxadiazole-2-thione

Systemtic Name: 5-methyl-3-[(4-phenylpiperazin-1-ium-1-yl)methyl]-1,3,4-oxadiazole-2-thione Openeye Name: 5-methyl-3-[(4-phenylpiperazin-1-ium-1-yl)methyl]-1,3,4-oxadiazole-2-thione CAS Name: 5-methyl-3-[(4-phenyl-1-piperazin-1-iumyl)methyl]-1,3,4-oxadiazole-2-thione IUPAC Name: 5-methyl-3-[(4-phenylpiperazin-1-ium-1-yl)methyl]-1,3,4-oxadiazole-2-thione Traditional Name: 5-methyl-3-[(4-phenylpiperazin-1-ium-1-yl)methyl]-1,3,4-oxadiazole-2-thione Formula: C14H19N4OS+ MolecularWeight: 291.39186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=S)O1)C[NH+]2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=S)O1)C[NH+]2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C14H18N4OS/c1-12-15-18(14(20)19-12)11-16-7-9-17(10-8-16)13-5-3-2-4-6-13/h2-6H,7-11H2,1H3/p+1