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

Systemtic Name: 6-[[2-(3-phenacylsulfanyl-1H-1,2,4-triazol-5-yl)hydrazinyl]methylidene]-2-prop-2-enyl-cyclohexa-2,4-dien-1-one Openeye Name: 2-allyl-6-[[2-(3-phenacylsulfanyl-1H-1,2,4-triazol-5-yl)hydrazino]methylene]cyclohexa-2,4-dien-1-one CAS Name: 6-[[[3-(phenacylthio)-1H-1,2,4-triazol-5-yl]hydrazo]methylidene]-2-prop-2-enyl-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[2-(3-phenacylsulfanyl-1H-1,2,4-triazol-5-yl)hydrazinyl]methylidene]-2-prop-2-enylcyclohexa-2,4-dien-1-one Traditional Name: 2-allyl-6-[[N'-[3-(phenacylthio)-1H-1,2,4-triazol-5-yl]hydrazino]methylene]cyclohexa-2,4-dien-1-one Formula: C20H19N5O2S MolecularWeight: 393.46216

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=CC=CC(=CNNC2=NC(=NN2)SCC(=O)C3=CC=CC=C3)C1=O

Isomeric SMILES

C=CCC1=CC=CC(=CNNC2=NC(=NN2)SCC(=O)C3=CC=CC=C3)C1=O

InChI

InChI=1S/C20H19N5O2S/c1-2-7-15-10-6-11-16(18(15)27)12-21-23-19-22-20(25-24-19)28-13-17(26)14-8-4-3-5-9-14/h2-6,8-12,21H,1,7,13H2,(H2,22,23,24,25)