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2-bromanyl-6-ethoxy-4-[pyrrolidin-1-yl(sulfanyl)methylidene]cyclohexa-2,5-dien-1-one

2-bromanyl-6-ethoxy-4-[pyrrolidin-1-yl(sulfanyl)methylidene]cyclohexa-2,5-dien-1-one

Systemtic Name:2-bromanyl-6-ethoxy-4-[pyrrolidin-1-yl(sulfanyl)methylidene]cyclohexa-2,5-dien-1-one
Openeye Name:2-bromo-6-ethoxy-4-[pyrrolidin-1-yl(sulfanyl)methylene]cyclohexa-2,5-dien-1-one
CAS Name:2-bromo-6-ethoxy-4-[mercapto(1-pyrrolidinyl)methylidene]-1-cyclohexa-2,5-dienone
IUPAC Name:2-bromo-6-ethoxy-4-[pyrrolidin-1-yl(sulfanyl)methylidene]cyclohexa-2,5-dien-1-one
Traditional Name:2-bromo-6-ethoxy-4-[mercapto(pyrrolidino)methylene]cyclohexa-2,5-dien-1-one
Formula: C13H16BrNO2S
MolecularWeight: 330.24064
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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(N2CCCC2)S)C=C(C1=O)Br


Isomeric SMILES

CCOC1=CC(=C(N2CCCC2)S)C=C(C1=O)Br


InChI

InChI=1S/C13H16BrNO2S/c1-2-17-11-8-9(7-10(14)12(11)16)13(18)15-5-3-4-6-15/h7-8,18H,2-6H2,1H3


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