N'-[(1E)-1-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)ethyl]azepane-1-carbothiohydrazide

Systemtic Name: N'-[(1E)-1-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)ethyl]azepane-1-carbothiohydrazide Openeye Name: N'-[(1E)-1-(6-oxocyclohexa-2,4-dien-1-ylidene)ethyl]azepane-1-carbothiohydrazide CAS Name: N'-[(1E)-1-(6-oxo-1-cyclohexa-2,4-dienylidene)ethyl]-1-azepanecarbothiohydrazide IUPAC Name: N'-[(1E)-1-(6-oxocyclohexa-2,4-dien-1-ylidene)ethyl]azepane-1-carbothiohydrazide Traditional Name: N'-[(1E)-1-(6-ketocyclohexa-2,4-dien-1-ylidene)ethyl]azepane-1-carbothiohydrazide Formula: C15H21N3OS MolecularWeight: 291.41174

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C=CC=CC1=O)NNC(=S)N2CCCCCC2

Isomeric SMILES

C/C(=C\1/C=CC=CC1=O)/NNC(=S)N2CCCCCC2

InChI

InChI=1S/C15H21N3OS/c1-12(13-8-4-5-9-14(13)19)16-17-15(20)18-10-6-2-3-7-11-18/h4-5,8-9,16H,2-3,6-7,10-11H2,1H3,(H,17,20)/b13-12+