6-[4-methyl-3-(pyridin-2-ylmethylsulfanyl)-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[4-methyl-3-(pyridin-2-ylmethylsulfanyl)-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: 6-[4-methyl-3-(2-pyridylmethylsulfanyl)-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,4-dien-1-one CAS Name: 6-[4-methyl-3-(2-pyridinylmethylthio)-1H-1,2,4-triazol-5-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[4-methyl-3-(pyridin-2-ylmethylsulfanyl)-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: 6-[4-methyl-3-(2-pyridylmethylthio)-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,4-dien-1-one Formula: C15H14N4OS MolecularWeight: 298.36286

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C2C=CC=CC2=O)NN=C1SCC3=CC=CC=N3

Isomeric SMILES

CN1C(=C2C=CC=CC2=O)NN=C1SCC3=CC=CC=N3

InChI

InChI=1S/C15H14N4OS/c1-19-14(12-7-2-3-8-13(12)20)17-18-15(19)21-10-11-6-4-5-9-16-11/h2-9,17H,10H2,1H3