6-[[2-(4-bromophenyl)sulfanylethylamino]methylidene]-4-methoxy-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[2-(4-bromophenyl)sulfanylethylamino]methylidene]-4-methoxy-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[2-(4-bromophenyl)sulfanylethylamino]methylene]-4-methoxy-cyclohexa-2,4-dien-1-one CAS Name: 6-[[2-[(4-bromophenyl)thio]ethylamino]methylidene]-4-methoxy-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[2-(4-bromophenyl)sulfanylethylamino]methylidene]-4-methoxycyclohexa-2,4-dien-1-one Traditional Name: 6-[[2-[(4-bromophenyl)thio]ethylamino]methylene]-4-methoxy-cyclohexa-2,4-dien-1-one Formula: C16H16BrNO2S MolecularWeight: 366.27274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CNCCSC2=CC=C(C=C2)Br)C(=O)C=C1

Isomeric SMILES

COC1=CC(=CNCCSC2=CC=C(C=C2)Br)C(=O)C=C1

InChI

InChI=1S/C16H16BrNO2S/c1-20-14-4-7-16(19)12(10-14)11-18-8-9-21-15-5-2-13(17)3-6-15/h2-7,10-11,18H,8-9H2,1H3