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

Systemtic Name: 4-cyclopropyl-5-pyridin-4-yl-2-[(4-pyridin-4-ylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione Openeye Name: 4-cyclopropyl-5-(4-pyridyl)-2-[[4-(4-pyridyl)piperazin-1-yl]methyl]-1,2,4-triazole-3-thione CAS Name: 4-cyclopropyl-5-pyridin-4-yl-2-[(4-pyridin-4-yl-1-piperazinyl)methyl]-1,2,4-triazole-3-thione IUPAC Name: 4-cyclopropyl-5-pyridin-4-yl-2-[(4-pyridin-4-ylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione Traditional Name: 4-cyclopropyl-5-(4-pyridyl)-2-[[4-(4-pyridyl)piperazino]methyl]-1,2,4-triazole-3-thione Formula: C20H23N7S MolecularWeight: 393.50852

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN(C2=S)CN3CCN(CC3)C4=CC=NC=C4)C5=CC=NC=C5

Isomeric SMILES

C1CC1N2C(=NN(C2=S)CN3CCN(CC3)C4=CC=NC=C4)C5=CC=NC=C5

InChI

InChI=1S/C20H23N7S/c28-20-26(15-24-11-13-25(14-12-24)17-5-9-22-10-6-17)23-19(27(20)18-1-2-18)16-3-7-21-8-4-16/h3-10,18H,1-2,11-15H2