4-[4-ethyl-3-(2-piperidin-1-ylethylsulfanyl)-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[4-ethyl-3-(2-piperidin-1-ylethylsulfanyl)-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[4-ethyl-3-[2-(1-piperidyl)ethylsulfanyl]-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[4-ethyl-3-[2-(1-piperidinyl)ethylthio]-1H-1,2,4-triazol-5-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[4-ethyl-3-(2-piperidin-1-ylethylsulfanyl)-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[4-ethyl-3-(2-piperidinoethylthio)-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,5-dien-1-one Formula: C17H24N4OS MolecularWeight: 332.46366

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C2C=CC(=O)C=C2)NN=C1SCCN3CCCCC3

Isomeric SMILES

CCN1C(=C2C=CC(=O)C=C2)NN=C1SCCN3CCCCC3

InChI

InChI=1S/C17H24N4OS/c1-2-21-16(14-6-8-15(22)9-7-14)18-19-17(21)23-13-12-20-10-4-3-5-11-20/h6-9,18H,2-5,10-13H2,1H3