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

Systemtic Name: 6-[[2-(4-chlorophenyl)sulfanylethylamino]methylidene]-2-methoxy-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[2-(4-chlorophenyl)sulfanylethylamino]methylene]-2-methoxy-cyclohexa-2,4-dien-1-one CAS Name: 6-[[2-[(4-chlorophenyl)thio]ethylamino]methylidene]-2-methoxy-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[2-(4-chlorophenyl)sulfanylethylamino]methylidene]-2-methoxycyclohexa-2,4-dien-1-one Traditional Name: 6-[[2-[(4-chlorophenyl)thio]ethylamino]methylene]-2-methoxy-cyclohexa-2,4-dien-1-one Formula: C16H16ClNO2S MolecularWeight: 321.82174

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16ClNO2S/c1-20-15-4-2-3-12(16(15)19)11-18-9-10-21-14-7-5-13(17)6-8-14/h2-8,11,18H,9-10H2,1H3