6-[[2-[(2-fluorophenyl)methylsulfanyl]ethylamino]methylidene]-4-nitro-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[2-[(2-fluorophenyl)methylsulfanyl]ethylamino]methylidene]-4-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[2-[(2-fluorophenyl)methylsulfanyl]ethylamino]methylene]-4-nitro-cyclohexa-2,4-dien-1-one CAS Name: 6-[[2-[(2-fluorophenyl)methylthio]ethylamino]methylidene]-4-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[2-[(2-fluorophenyl)methylsulfanyl]ethylamino]methylidene]-4-nitrocyclohexa-2,4-dien-1-one Traditional Name: 6-[[2-[(2-fluorobenzyl)thio]ethylamino]methylene]-4-nitro-cyclohexa-2,4-dien-1-one Formula: C16H15FN2O3S MolecularWeight: 334.365303

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSCCNC=C2C=C(C=CC2=O)[N+](=O)[O-])F

Isomeric SMILES

C1=CC=C(C(=C1)CSCCNC=C2C=C(C=CC2=O)[N+](=O)[O-])F

InChI

InChI=1S/C16H15FN2O3S/c17-15-4-2-1-3-12(15)11-23-8-7-18-10-13-9-14(19(21)22)5-6-16(13)20/h1-6,9-10,18H,7-8,11H2