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

Systemtic Name: 4-[[2-(3-phenacylsulfanyl-1H-1,2,4-triazol-5-yl)hydrazinyl]methylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[[2-(3-phenacylsulfanyl-1H-1,2,4-triazol-5-yl)hydrazino]methylene]cyclohexa-2,5-dien-1-one CAS Name: 4-[[[3-(phenacylthio)-1H-1,2,4-triazol-5-yl]hydrazo]methylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[[2-(3-phenacylsulfanyl-1H-1,2,4-triazol-5-yl)hydrazinyl]methylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[[N'-[3-(phenacylthio)-1H-1,2,4-triazol-5-yl]hydrazino]methylene]cyclohexa-2,5-dien-1-one Formula: C17H15N5O2S MolecularWeight: 353.3983

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CSC2=NNC(=N2)NNC=C3C=CC(=O)C=C3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CSC2=NNC(=N2)NNC=C3C=CC(=O)C=C3

InChI

InChI=1S/C17H15N5O2S/c23-14-8-6-12(7-9-14)10-18-20-16-19-17(22-21-16)25-11-15(24)13-4-2-1-3-5-13/h1-10,18H,11H2,(H2,19,20,21,22)