5-[[3-bromanyl-5-methoxy-4-(pyridin-2-ylmethoxy)phenyl]methylidene]-2-sulfanylidene-imidazolidin-4-one

Systemtic Name: 5-[[3-bromanyl-5-methoxy-4-(pyridin-2-ylmethoxy)phenyl]methylidene]-2-sulfanylidene-imidazolidin-4-one Openeye Name: 5-[[3-bromo-5-methoxy-4-(2-pyridylmethoxy)phenyl]methylene]-2-thioxo-imidazolidin-4-one CAS Name: 5-[[3-bromo-5-methoxy-4-(2-pyridinylmethoxy)phenyl]methylidene]-2-sulfanylidene-4-imidazolidinone IUPAC Name: 5-[[3-bromo-5-methoxy-4-(pyridin-2-ylmethoxy)phenyl]methylidene]-2-sulfanylideneimidazolidin-4-one Traditional Name: 5-[3-bromo-5-methoxy-4-(2-pyridylmethoxy)benzylidene]-2-thioxo-4-imidazolidinone Formula: C17H14BrN3O3S MolecularWeight: 420.28036

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C2C(=O)NC(=S)N2)Br)OCC3=CC=CC=N3

Isomeric SMILES

COC1=C(C(=CC(=C1)C=C2C(=O)NC(=S)N2)Br)OCC3=CC=CC=N3

InChI

InChI=1S/C17H14BrN3O3S/c1-23-14-8-10(7-13-16(22)21-17(25)20-13)6-12(18)15(14)24-9-11-4-2-3-5-19-11/h2-8H,9H2,1H3,(H2,20,21,22,25)