2-[[(5-chloranylthiophen-2-yl)methyl-ethyl-amino]methyl]-4-phenyl-1,2,4-triazole-3-thione

Systemtic Name: 2-[[(5-chloranylthiophen-2-yl)methyl-ethyl-amino]methyl]-4-phenyl-1,2,4-triazole-3-thione Openeye Name: 2-[[(5-chloro-2-thienyl)methyl-ethyl-amino]methyl]-4-phenyl-1,2,4-triazole-3-thione CAS Name: 2-[[(5-chloro-2-thiophenyl)methyl-ethylamino]methyl]-4-phenyl-1,2,4-triazole-3-thione IUPAC Name: 2-[[(5-chlorothiophen-2-yl)methyl-ethylamino]methyl]-4-phenyl-1,2,4-triazole-3-thione Traditional Name: 2-[[(5-chloro-2-thienyl)methyl-ethyl-amino]methyl]-4-phenyl-1,2,4-triazole-3-thione Formula: C16H17ClN4S2 MolecularWeight: 364.91598

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=C(S1)Cl)CN2C(=S)N(C=N2)C3=CC=CC=C3

Isomeric SMILES

CCN(CC1=CC=C(S1)Cl)CN2C(=S)N(C=N2)C3=CC=CC=C3

InChI

InChI=1S/C16H17ClN4S2/c1-2-19(10-14-8-9-15(17)23-14)12-21-16(22)20(11-18-21)13-6-4-3-5-7-13/h3-9,11H,2,10,12H2,1H3