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

Systemtic Name: 4-prop-2-enyl-5-pyridin-4-yl-2-[(4-pyridin-2-ylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione Openeye Name: 4-allyl-5-(4-pyridyl)-2-[[4-(2-pyridyl)piperazin-1-yl]methyl]-1,2,4-triazole-3-thione CAS Name: 4-prop-2-enyl-5-pyridin-4-yl-2-[[4-(2-pyridinyl)-1-piperazinyl]methyl]-1,2,4-triazole-3-thione IUPAC Name: 4-prop-2-enyl-5-pyridin-4-yl-2-[(4-pyridin-2-ylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione Traditional Name: 4-allyl-5-(4-pyridyl)-2-[[4-(2-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=CC=N3)C4=CC=NC=C4

Isomeric SMILES

C=CCN1C(=NN(C1=S)CN2CCN(CC2)C3=CC=CC=N3)C4=CC=NC=C4

InChI

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