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

Systemtic Name: 4-[(3-ethoxy-4-phenylmethoxy-phenyl)methylidene]-2-propylsulfanyl-1,3-thiazol-5-one Openeye Name: 4-[(4-benzyloxy-3-ethoxy-phenyl)methylene]-2-propylsulfanyl-thiazol-5-one CAS Name: 4-[(3-ethoxy-4-phenylmethoxyphenyl)methylidene]-2-(propylthio)-5-thiazolone IUPAC Name: 4-[(3-ethoxy-4-phenylmethoxyphenyl)methylidene]-2-propylsulfanyl-1,3-thiazol-5-one Traditional Name: 4-(4-benzoxy-3-ethoxy-benzylidene)-2-(propylthio)-2-thiazolin-5-one Formula: C22H23NO3S2 MolecularWeight: 413.55292

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23NO3S2/c1-3-12-27-22-23-18(21(24)28-22)13-17-10-11-19(20(14-17)25-4-2)26-15-16-8-6-5-7-9-16/h5-11,13-14H,3-4,12,15H2,1-2H3