4-[[4-(3-methylbut-2-enoxy)phenyl]methylidene]-2-(phenylmethylsulfanyl)-1,3-thiazol-5-one

Systemtic Name: 4-[[4-(3-methylbut-2-enoxy)phenyl]methylidene]-2-(phenylmethylsulfanyl)-1,3-thiazol-5-one Openeye Name: 2-benzylsulfanyl-4-[[4-(3-methylbut-2-enoxy)phenyl]methylene]thiazol-5-one CAS Name: 4-[[4-(3-methylbut-2-enoxy)phenyl]methylidene]-2-(phenylmethylthio)-5-thiazolone IUPAC Name: 2-benzylsulfanyl-4-[[4-(3-methylbut-2-enoxy)phenyl]methylidene]-1,3-thiazol-5-one Traditional Name: 2-(benzylthio)-4-[4-(3-methylbut-2-enoxy)benzylidene]-2-thiazolin-5-one Formula: C22H21NO2S2 MolecularWeight: 395.53764

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCOC1=CC=C(C=C1)C=C2C(=O)SC(=N2)SCC3=CC=CC=C3)C

Isomeric SMILES

CC(=CCOC1=CC=C(C=C1)C=C2C(=O)SC(=N2)SCC3=CC=CC=C3)C

InChI

InChI=1S/C22H21NO2S2/c1-16(2)12-13-25-19-10-8-17(9-11-19)14-20-21(24)27-22(23-20)26-15-18-6-4-3-5-7-18/h3-12,14H,13,15H2,1-2H3