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

Systemtic Name: 4-methyl-2-[[(5-methylthiophen-2-yl)methyl-phenethyl-amino]methyl]-5-pyridin-3-yl-1,2,4-triazole-3-thione Openeye Name: 4-methyl-2-[[(5-methyl-2-thienyl)methyl-phenethyl-amino]methyl]-5-(3-pyridyl)-1,2,4-triazole-3-thione CAS Name: 4-methyl-2-[[(5-methyl-2-thiophenyl)methyl-phenethylamino]methyl]-5-(3-pyridinyl)-1,2,4-triazole-3-thione IUPAC Name: 4-methyl-2-[[(5-methylthiophen-2-yl)methyl-phenethylamino]methyl]-5-pyridin-3-yl-1,2,4-triazole-3-thione Traditional Name: 4-methyl-2-[[(5-methyl-2-thienyl)methyl-phenethyl-amino]methyl]-5-(3-pyridyl)-1,2,4-triazole-3-thione Formula: C23H25N5S2 MolecularWeight: 435.6081

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)CN(CCC2=CC=CC=C2)CN3C(=S)N(C(=N3)C4=CN=CC=C4)C

Isomeric SMILES

CC1=CC=C(S1)CN(CCC2=CC=CC=C2)CN3C(=S)N(C(=N3)C4=CN=CC=C4)C

InChI

InChI=1S/C23H25N5S2/c1-18-10-11-21(30-18)16-27(14-12-19-7-4-3-5-8-19)17-28-23(29)26(2)22(25-28)20-9-6-13-24-15-20/h3-11,13,15H,12,14,16-17H2,1-2H3