ethyl 2-[2-[6-(4-bromophenyl)-3-cyano-4-phenyl-pyridin-2-yl]sulfanyl-3,4-dihydro-2H-naphthalen-1-ylidene]-2-cyano-ethanoate

Systemtic Name: ethyl 2-[2-[6-(4-bromophenyl)-3-cyano-4-phenyl-pyridin-2-yl]sulfanyl-3,4-dihydro-2H-naphthalen-1-ylidene]-2-cyano-ethanoate Openeye Name: ethyl 2-[2-[[6-(4-bromophenyl)-3-cyano-4-phenyl-2-pyridyl]sulfanyl]tetralin-1-ylidene]-2-cyano-acetate CAS Name: 2-[2-[[6-(4-bromophenyl)-3-cyano-4-phenyl-2-pyridinyl]thio]-3,4-dihydro-2H-naphthalen-1-ylidene]-2-cyanoacetic acid ethyl ester IUPAC Name: ethyl 2-[2-[6-(4-bromophenyl)-3-cyano-4-phenylpyridin-2-yl]sulfanyl-3,4-dihydro-2H-naphthalen-1-ylidene]-2-cyanoacetate Traditional Name: 2-[2-[[6-(4-bromophenyl)-3-cyano-4-phenyl-2-pyridyl]thio]tetralin-1-ylidene]-2-cyano-acetic acid ethyl ester Formula: C33H24BrN3O2S MolecularWeight: 606.53156

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C1C(CCC2=CC=CC=C21)SC3=C(C(=CC(=N3)C4=CC=C(C=C4)Br)C5=CC=CC=C5)C#N)C#N

Isomeric SMILES

CCOC(=O)C(=C1C(CCC2=CC=CC=C21)SC3=C(C(=CC(=N3)C4=CC=C(C=C4)Br)C5=CC=CC=C5)C#N)C#N

InChI

InChI=1S/C33H24BrN3O2S/c1-2-39-33(38)28(20-36)31-25-11-7-6-10-22(25)14-17-30(31)40-32-27(19-35)26(21-8-4-3-5-9-21)18-29(37-32)23-12-15-24(34)16-13-23/h3-13,15-16,18,30H,2,14,17H2,1H3