4-(furan-2-ylmethyl)-2-[[methyl(1-thiophen-2-ylethyl)amino]methyl]-5-pyridin-3-yl-1,2,4-triazole-3-thione

Systemtic Name: 4-(furan-2-ylmethyl)-2-[[methyl(1-thiophen-2-ylethyl)amino]methyl]-5-pyridin-3-yl-1,2,4-triazole-3-thione Openeye Name: 4-(2-furylmethyl)-2-[[methyl-[1-(2-thienyl)ethyl]amino]methyl]-5-(3-pyridyl)-1,2,4-triazole-3-thione CAS Name: 4-(2-furanylmethyl)-2-[[methyl(1-thiophen-2-ylethyl)amino]methyl]-5-(3-pyridinyl)-1,2,4-triazole-3-thione IUPAC Name: 4-(furan-2-ylmethyl)-2-[[methyl(1-thiophen-2-ylethyl)amino]methyl]-5-pyridin-3-yl-1,2,4-triazole-3-thione Traditional Name: 4-(2-furfuryl)-2-[[methyl-[1-(2-thienyl)ethyl]amino]methyl]-5-(3-pyridyl)-1,2,4-triazole-3-thione Formula: C20H21N5OS2 MolecularWeight: 411.54364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CS1)N(C)CN2C(=S)N(C(=N2)C3=CN=CC=C3)CC4=CC=CO4

Isomeric SMILES

CC(C1=CC=CS1)N(C)CN2C(=S)N(C(=N2)C3=CN=CC=C3)CC4=CC=CO4

InChI

InChI=1S/C20H21N5OS2/c1-15(18-8-5-11-28-18)23(2)14-25-20(27)24(13-17-7-4-10-26-17)19(22-25)16-6-3-9-21-12-16/h3-12,15H,13-14H2,1-2H3