6-[[2-(3-propan-2-ylsulfanyl-1H-1,2,4-triazol-5-yl)hydrazinyl]methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[2-(3-propan-2-ylsulfanyl-1H-1,2,4-triazol-5-yl)hydrazinyl]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: 6-[[2-(3-isopropylsulfanyl-1H-1,2,4-triazol-5-yl)hydrazino]methylene]cyclohexa-2,4-dien-1-one CAS Name: 6-[[[3-(propan-2-ylthio)-1H-1,2,4-triazol-5-yl]hydrazo]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[2-(3-propan-2-ylsulfanyl-1H-1,2,4-triazol-5-yl)hydrazinyl]methylidene]cyclohexa-2,4-dien-1-one Traditional Name: 6-[[N'-[3-(isopropylthio)-1H-1,2,4-triazol-5-yl]hydrazino]methylene]cyclohexa-2,4-dien-1-one Formula: C12H15N5OS MolecularWeight: 277.3454

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NNC(=N1)NNC=C2C=CC=CC2=O

Isomeric SMILES

CC(C)SC1=NNC(=N1)NNC=C2C=CC=CC2=O

InChI

InChI=1S/C12H15N5OS/c1-8(2)19-12-14-11(16-17-12)15-13-7-9-5-3-4-6-10(9)18/h3-8,13H,1-2H3,(H2,14,15,16,17)