4-(2,4-dimethylphenyl)-2-[(4-ethylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione

Systemtic Name: 4-(2,4-dimethylphenyl)-2-[(4-ethylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione Openeye Name: 4-(2,4-dimethylphenyl)-2-[(4-ethylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione CAS Name: 4-(2,4-dimethylphenyl)-2-[(4-ethyl-1-piperazinyl)methyl]-1,2,4-triazole-3-thione IUPAC Name: 4-(2,4-dimethylphenyl)-2-[(4-ethylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione Traditional Name: 4-(2,4-dimethylphenyl)-2-[(4-ethylpiperazino)methyl]-1,2,4-triazole-3-thione Formula: C17H25N5S MolecularWeight: 331.4789

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CN2C(=S)N(C=N2)C3=C(C=C(C=C3)C)C

Isomeric SMILES

CCN1CCN(CC1)CN2C(=S)N(C=N2)C3=C(C=C(C=C3)C)C

InChI

InChI=1S/C17H25N5S/c1-4-19-7-9-20(10-8-19)13-22-17(23)21(12-18-22)16-6-5-14(2)11-15(16)3/h5-6,11-12H,4,7-10,13H2,1-3H3