2-[[cyclopropyl(pyridin-3-ylmethyl)amino]methyl]-5-[(E)-2-(4-fluorophenyl)ethenyl]-1H-1,2,4-triazole-3-thione

Systemtic Name: 2-[[cyclopropyl(pyridin-3-ylmethyl)amino]methyl]-5-[(E)-2-(4-fluorophenyl)ethenyl]-1H-1,2,4-triazole-3-thione Openeye Name: 2-[[cyclopropyl(3-pyridylmethyl)amino]methyl]-5-[(E)-2-(4-fluorophenyl)vinyl]-1H-1,2,4-triazole-3-thione CAS Name: 2-[[cyclopropyl(3-pyridinylmethyl)amino]methyl]-5-[(E)-2-(4-fluorophenyl)ethenyl]-1H-1,2,4-triazole-3-thione IUPAC Name: 2-[[cyclopropyl(pyridin-3-ylmethyl)amino]methyl]-5-[(E)-2-(4-fluorophenyl)ethenyl]-1H-1,2,4-triazole-3-thione Traditional Name: 2-[[cyclopropyl(3-pyridylmethyl)amino]methyl]-5-[(E)-2-(4-fluorophenyl)vinyl]-1H-1,2,4-triazole-3-thione Formula: C20H20FN5S MolecularWeight: 381.469703

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(CC2=CN=CC=C2)CN3C(=S)N=C(N3)C=CC4=CC=C(C=C4)F

Isomeric SMILES

C1CC1N(CC2=CN=CC=C2)CN3C(=S)N=C(N3)/C=C/C4=CC=C(C=C4)F

InChI

InChI=1S/C20H20FN5S/c21-17-6-3-15(4-7-17)5-10-19-23-20(27)26(24-19)14-25(18-8-9-18)13-16-2-1-11-22-12-16/h1-7,10-12,18H,8-9,13-14H2,(H,23,24,27)/b10-5+