(4E)-4-[(hexylamino)-sulfanyl-methylidene]-3-oxidanyl-cyclohexa-2,5-dien-1-one

Systemtic Name: (4E)-4-[(hexylamino)-sulfanyl-methylidene]-3-oxidanyl-cyclohexa-2,5-dien-1-one Openeye Name: (4E)-4-[(hexylamino)-sulfanyl-methylene]-3-hydroxy-cyclohexa-2,5-dien-1-one CAS Name: (4E)-4-[(hexylamino)-mercaptomethylidene]-3-hydroxy-1-cyclohexa-2,5-dienone IUPAC Name: (4E)-4-[(hexylamino)-sulfanylmethylidene]-3-hydroxycyclohexa-2,5-dien-1-one Traditional Name: (4E)-4-[(hexylamino)-mercapto-methylene]-3-hydroxy-cyclohexa-2,5-dien-1-one Formula: C13H19NO2S MolecularWeight: 253.36046

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=C1C=CC(=O)C=C1O)S

Isomeric SMILES

CCCCCCN/C(=C\1/C=CC(=O)C=C1O)/S

InChI

InChI=1S/C13H19NO2S/c1-2-3-4-5-8-14-13(17)11-7-6-10(15)9-12(11)16/h6-7,9,14,16-17H,2-5,8H2,1H3/b13-11+