6-[[2-[(5-bromanylthiophen-2-yl)methylsulfanyl]ethylamino]methylidene]-2-ethoxy-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[2-[(5-bromanylthiophen-2-yl)methylsulfanyl]ethylamino]methylidene]-2-ethoxy-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[2-[(5-bromo-2-thienyl)methylsulfanyl]ethylamino]methylene]-2-ethoxy-cyclohexa-2,4-dien-1-one CAS Name: 6-[[2-[(5-bromo-2-thiophenyl)methylthio]ethylamino]methylidene]-2-ethoxy-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[2-[(5-bromothiophen-2-yl)methylsulfanyl]ethylamino]methylidene]-2-ethoxycyclohexa-2,4-dien-1-one Traditional Name: 6-[[2-[(5-bromo-2-thienyl)methylthio]ethylamino]methylene]-2-ethoxy-cyclohexa-2,4-dien-1-one Formula: C16H18BrNO2S2 MolecularWeight: 400.35362

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=CNCCSCC2=CC=C(S2)Br)C1=O

Isomeric SMILES

CCOC1=CC=CC(=CNCCSCC2=CC=C(S2)Br)C1=O

InChI

InChI=1S/C16H18BrNO2S2/c1-2-20-14-5-3-4-12(16(14)19)10-18-8-9-21-11-13-6-7-15(17)22-13/h3-7,10,18H,2,8-9,11H2,1H3