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

Systemtic Name: (4E)-4-[(cyclohexylamino)-sulfanyl-methylidene]-3-oxidanyl-cyclohexa-2,5-dien-1-one Openeye Name: (4E)-4-[(cyclohexylamino)-sulfanyl-methylene]-3-hydroxy-cyclohexa-2,5-dien-1-one CAS Name: (4E)-4-[(cyclohexylamino)-mercaptomethylidene]-3-hydroxy-1-cyclohexa-2,5-dienone IUPAC Name: (4E)-4-[(cyclohexylamino)-sulfanylmethylidene]-3-hydroxycyclohexa-2,5-dien-1-one Traditional Name: (4E)-4-[(cyclohexylamino)-mercapto-methylene]-3-hydroxy-cyclohexa-2,5-dien-1-one Formula: C13H17NO2S MolecularWeight: 251.34458

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=C2C=CC(=O)C=C2O)S

Isomeric SMILES

C1CCC(CC1)N/C(=C\2/C=CC(=O)C=C2O)/S

InChI

InChI=1S/C13H17NO2S/c15-10-6-7-11(12(16)8-10)13(17)14-9-4-2-1-3-5-9/h6-9,14,16-17H,1-5H2/b13-11+