(4E)-3-oxidanyl-4-[1-(2-sulfanylethylamino)ethylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: (4E)-3-oxidanyl-4-[1-(2-sulfanylethylamino)ethylidene]cyclohexa-2,5-dien-1-one Openeye Name: (4E)-3-hydroxy-4-[1-(2-sulfanylethylamino)ethylidene]cyclohexa-2,5-dien-1-one CAS Name: (4E)-3-hydroxy-4-[1-(2-mercaptoethylamino)ethylidene]-1-cyclohexa-2,5-dienone IUPAC Name: (4E)-3-hydroxy-4-[1-(2-sulfanylethylamino)ethylidene]cyclohexa-2,5-dien-1-one Traditional Name: (4E)-3-hydroxy-4-[1-(2-mercaptoethylamino)ethylidene]cyclohexa-2,5-dien-1-one Formula: C10H13NO2S MolecularWeight: 211.28072

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C=CC(=O)C=C1O)NCCS

Isomeric SMILES

C/C(=C\1/C=CC(=O)C=C1O)/NCCS

InChI

InChI=1S/C10H13NO2S/c1-7(11-4-5-14)9-3-2-8(12)6-10(9)13/h2-3,6,11,13-14H,4-5H2,1H3/b9-7+