4-[4-ethyl-1-[(4-pyridin-2-ylpiperazin-1-yl)methyl]-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[4-ethyl-1-[(4-pyridin-2-ylpiperazin-1-yl)methyl]-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[4-ethyl-1-[[4-(2-pyridyl)piperazin-1-yl]methyl]-5-thioxo-1,2,4-triazolidin-3-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[4-ethyl-1-[[4-(2-pyridinyl)-1-piperazinyl]methyl]-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[4-ethyl-1-[(4-pyridin-2-ylpiperazin-1-yl)methyl]-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[4-ethyl-1-[[4-(2-pyridyl)piperazino]methyl]-5-thioxo-1,2,4-triazolidin-3-ylidene]cyclohexa-2,5-dien-1-one Formula: C20H24N6OS MolecularWeight: 396.50916

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C2C=CC(=O)C=C2)NN(C1=S)CN3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

CCN1C(=C2C=CC(=O)C=C2)NN(C1=S)CN3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C20H24N6OS/c1-2-25-19(16-6-8-17(27)9-7-16)22-26(20(25)28)15-23-11-13-24(14-12-23)18-5-3-4-10-21-18/h3-10,22H,2,11-15H2,1H3