4-[(3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)methylidene]-2-propylsulfanyl-1,3-thiazol-5-one

Systemtic Name: 4-[(3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)methylidene]-2-propylsulfanyl-1,3-thiazol-5-one Openeye Name: 4-[(4-benzyloxy-3-bromo-5-methoxy-phenyl)methylene]-2-propylsulfanyl-thiazol-5-one CAS Name: 4-[(3-bromo-5-methoxy-4-phenylmethoxyphenyl)methylidene]-2-(propylthio)-5-thiazolone IUPAC Name: 4-[(3-bromo-5-methoxy-4-phenylmethoxyphenyl)methylidene]-2-propylsulfanyl-1,3-thiazol-5-one Traditional Name: 4-(4-benzoxy-3-bromo-5-methoxy-benzylidene)-2-(propylthio)-2-thiazolin-5-one Formula: C21H20BrNO3S2 MolecularWeight: 478.4224

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC(=CC2=CC(=C(C(=C2)Br)OCC3=CC=CC=C3)OC)C(=O)S1

Isomeric SMILES

CCCSC1=NC(=CC2=CC(=C(C(=C2)Br)OCC3=CC=CC=C3)OC)C(=O)S1

InChI

InChI=1S/C21H20BrNO3S2/c1-3-9-27-21-23-17(20(24)28-21)11-15-10-16(22)19(18(12-15)25-2)26-13-14-7-5-4-6-8-14/h4-8,10-12H,3,9,13H2,1-2H3