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

Systemtic Name: 4-cyclopropyl-5-pyridin-4-yl-2-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione Openeye Name: 4-cyclopropyl-5-(4-pyridyl)-2-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione CAS Name: 4-cyclopropyl-5-pyridin-4-yl-2-[[4-(2-pyrimidinyl)-1-piperazinyl]methyl]-1,2,4-triazole-3-thione IUPAC Name: 4-cyclopropyl-5-pyridin-4-yl-2-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione Traditional Name: 4-cyclopropyl-5-(4-pyridyl)-2-[[4-(2-pyrimidyl)piperazino]methyl]-1,2,4-triazole-3-thione Formula: C19H22N8S MolecularWeight: 394.49658

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN(C2=S)CN3CCN(CC3)C4=NC=CC=N4)C5=CC=NC=C5

Isomeric SMILES

C1CC1N2C(=NN(C2=S)CN3CCN(CC3)C4=NC=CC=N4)C5=CC=NC=C5

InChI

InChI=1S/C19H22N8S/c28-19-26(14-24-10-12-25(13-11-24)18-21-6-1-7-22-18)23-17(27(19)16-2-3-16)15-4-8-20-9-5-15/h1,4-9,16H,2-3,10-14H2