2-[[5-bromanyl-4-[(Z)-(1-ethyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene)methyl]-2-methoxy-phenoxy]methyl]benzenecarbonitrile

Systemtic Name: 2-[[5-bromanyl-4-[(Z)-(1-ethyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene)methyl]-2-methoxy-phenoxy]methyl]benzenecarbonitrile Openeye Name: 2-[[5-bromo-4-[(Z)-(1-ethyl-5-oxo-2-thioxo-imidazolidin-4-ylidene)methyl]-2-methoxy-phenoxy]methyl]benzonitrile CAS Name: 2-[[5-bromo-4-[(Z)-(1-ethyl-5-oxo-2-sulfanylidene-4-imidazolidinylidene)methyl]-2-methoxyphenoxy]methyl]benzonitrile IUPAC Name: 2-[[5-bromo-4-[(Z)-(1-ethyl-5-oxo-2-sulfanylideneimidazolidin-4-ylidene)methyl]-2-methoxyphenoxy]methyl]benzonitrile Traditional Name: 2-[[5-bromo-4-[(Z)-(1-ethyl-5-keto-2-thioxo-imidazolidin-4-ylidene)methyl]-2-methoxy-phenoxy]methyl]benzonitrile Formula: C21H18BrN3O3S MolecularWeight: 472.35492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=CC2=CC(=C(C=C2Br)OCC3=CC=CC=C3C#N)OC)NC1=S

Isomeric SMILES

CCN1C(=O)/C(=C/C2=CC(=C(C=C2Br)OCC3=CC=CC=C3C#N)OC)/NC1=S

InChI

InChI=1S/C21H18BrN3O3S/c1-3-25-20(26)17(24-21(25)29)8-15-9-18(27-2)19(10-16(15)22)28-12-14-7-5-4-6-13(14)11-23/h4-10H,3,12H2,1-2H3,(H,24,29)/b17-8-