5-(4-chlorophenyl)-2-[(4-ethylpiperazin-1-yl)methyl]-4-methyl-1,2,4-triazole-3-thione

Systemtic Name: 5-(4-chlorophenyl)-2-[(4-ethylpiperazin-1-yl)methyl]-4-methyl-1,2,4-triazole-3-thione Openeye Name: 5-(4-chlorophenyl)-2-[(4-ethylpiperazin-1-yl)methyl]-4-methyl-1,2,4-triazole-3-thione CAS Name: 5-(4-chlorophenyl)-2-[(4-ethyl-1-piperazinyl)methyl]-4-methyl-1,2,4-triazole-3-thione IUPAC Name: 5-(4-chlorophenyl)-2-[(4-ethylpiperazin-1-yl)methyl]-4-methyl-1,2,4-triazole-3-thione Traditional Name: 5-(4-chlorophenyl)-2-[(4-ethylpiperazino)methyl]-4-methyl-1,2,4-triazole-3-thione Formula: C16H22ClN5S MolecularWeight: 351.89738

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22ClN5S/c1-3-20-8-10-21(11-9-20)12-22-16(23)19(2)15(18-22)13-4-6-14(17)7-5-13/h4-7H,3,8-12H2,1-2H3