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

Systemtic Name: 4-prop-2-enyl-5-pyridin-3-yl-2-[(4-pyridin-4-ylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione Openeye Name: 4-allyl-5-(3-pyridyl)-2-[[4-(4-pyridyl)piperazin-1-yl]methyl]-1,2,4-triazole-3-thione CAS Name: 4-prop-2-enyl-5-(3-pyridinyl)-2-[(4-pyridin-4-yl-1-piperazinyl)methyl]-1,2,4-triazole-3-thione IUPAC Name: 4-prop-2-enyl-5-pyridin-3-yl-2-[(4-pyridin-4-ylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione Traditional Name: 4-allyl-5-(3-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:

C=CCN1C(=NN(C1=S)CN2CCN(CC2)C3=CC=NC=C3)C4=CN=CC=C4

Isomeric SMILES

C=CCN1C(=NN(C1=S)CN2CCN(CC2)C3=CC=NC=C3)C4=CN=CC=C4

InChI

InChI=1S/C20H23N7S/c1-2-10-26-19(17-4-3-7-22-15-17)23-27(20(26)28)16-24-11-13-25(14-12-24)18-5-8-21-9-6-18/h2-9,15H,1,10-14,16H2