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

Systemtic Name: 4-cyclopropyl-2-[[cyclopropyl-[(4-fluorophenyl)methyl]amino]methyl]-5-pyridin-4-yl-1,2,4-triazole-3-thione Openeye Name: 4-cyclopropyl-2-[[cyclopropyl-[(4-fluorophenyl)methyl]amino]methyl]-5-(4-pyridyl)-1,2,4-triazole-3-thione CAS Name: 4-cyclopropyl-2-[[cyclopropyl-[(4-fluorophenyl)methyl]amino]methyl]-5-pyridin-4-yl-1,2,4-triazole-3-thione IUPAC Name: 4-cyclopropyl-2-[[cyclopropyl-[(4-fluorophenyl)methyl]amino]methyl]-5-pyridin-4-yl-1,2,4-triazole-3-thione Traditional Name: 4-cyclopropyl-2-[[cyclopropyl-(4-fluorobenzyl)amino]methyl]-5-(4-pyridyl)-1,2,4-triazole-3-thione Formula: C21H22FN5S MolecularWeight: 395.496283

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN(C2=S)CN(CC3=CC=C(C=C3)F)C4CC4)C5=CC=NC=C5

Isomeric SMILES

C1CC1N2C(=NN(C2=S)CN(CC3=CC=C(C=C3)F)C4CC4)C5=CC=NC=C5

InChI

InChI=1S/C21H22FN5S/c22-17-3-1-15(2-4-17)13-25(18-5-6-18)14-26-21(28)27(19-7-8-19)20(24-26)16-9-11-23-12-10-16/h1-4,9-12,18-19H,5-8,13-14H2