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

Systemtic Name: 2-[[(5-chloranylthiophen-2-yl)methyl-ethyl-amino]methyl]-4-methyl-5-pyridin-4-yl-1,2,4-triazole-3-thione Openeye Name: 2-[[(5-chloro-2-thienyl)methyl-ethyl-amino]methyl]-4-methyl-5-(4-pyridyl)-1,2,4-triazole-3-thione CAS Name: 2-[[(5-chloro-2-thiophenyl)methyl-ethylamino]methyl]-4-methyl-5-pyridin-4-yl-1,2,4-triazole-3-thione IUPAC Name: 2-[[(5-chlorothiophen-2-yl)methyl-ethylamino]methyl]-4-methyl-5-pyridin-4-yl-1,2,4-triazole-3-thione Traditional Name: 2-[[(5-chloro-2-thienyl)methyl-ethyl-amino]methyl]-4-methyl-5-(4-pyridyl)-1,2,4-triazole-3-thione Formula: C16H18ClN5S2 MolecularWeight: 379.93062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18ClN5S2/c1-3-21(10-13-4-5-14(17)24-13)11-22-16(23)20(2)15(19-22)12-6-8-18-9-7-12/h4-9H,3,10-11H2,1-2H3