2-propyl-3-sulfanyl-cyclohexa-2,5-dien-1-one

Systemtic Name: 2-propyl-3-sulfanyl-cyclohexa-2,5-dien-1-one Openeye Name: 2-propyl-3-sulfanyl-cyclohexa-2,5-dien-1-one CAS Name: 3-mercapto-2-propyl-1-cyclohexa-2,5-dienone IUPAC Name: 2-propyl-3-sulfanylcyclohexa-2,5-dien-1-one Traditional Name: 3-mercapto-2-propyl-cyclohexa-2,5-dien-1-one Formula: C9H12OS MolecularWeight: 168.25598

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(CC=CC1=O)S

Isomeric SMILES

CCCC1=C(CC=CC1=O)S

InChI

InChI=1S/C9H12OS/c1-2-4-7-8(10)5-3-6-9(7)11/h3,5,11H,2,4,6H2,1H3