4-ethyl-2-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methyl]-5-pyridin-4-yl-1,2,4-triazole-3-thione

Systemtic Name: 4-ethyl-2-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methyl]-5-pyridin-4-yl-1,2,4-triazole-3-thione Openeye Name: 4-ethyl-2-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methyl]-5-(4-pyridyl)-1,2,4-triazole-3-thione CAS Name: 4-ethyl-2-[[4-(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)-1-piperazinyl]methyl]-5-pyridin-4-yl-1,2,4-triazole-3-thione IUPAC Name: 4-ethyl-2-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methyl]-5-pyridin-4-yl-1,2,4-triazole-3-thione Traditional Name: 4-ethyl-2-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazino]methyl]-5-(4-pyridyl)-1,2,4-triazole-3-thione Formula: C20H24N10S MolecularWeight: 436.53656

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN(C1=S)CN2CCN(CC2)C3=NC=NC4=C3C=NN4C)C5=CC=NC=C5

Isomeric SMILES

CCN1C(=NN(C1=S)CN2CCN(CC2)C3=NC=NC4=C3C=NN4C)C5=CC=NC=C5

InChI

InChI=1S/C20H24N10S/c1-3-29-17(15-4-6-21-7-5-15)25-30(20(29)31)14-27-8-10-28(11-9-27)19-16-12-24-26(2)18(16)22-13-23-19/h4-7,12-13H,3,8-11,14H2,1-2H3