(5E)-5-[(4-tert-butylphenyl)methylidene]-2-(4-ethanoylpiperazin-1-yl)-1,3-thiazol-4-one

Systemtic Name: (5E)-5-[(4-tert-butylphenyl)methylidene]-2-(4-ethanoylpiperazin-1-yl)-1,3-thiazol-4-one Openeye Name: (5E)-2-(4-acetylpiperazin-1-yl)-5-[(4-tert-butylphenyl)methylene]thiazol-4-one CAS Name: (5E)-2-(4-acetyl-1-piperazinyl)-5-[(4-tert-butylphenyl)methylidene]-4-thiazolone IUPAC Name: (5E)-2-(4-acetylpiperazin-1-yl)-5-[(4-tert-butylphenyl)methylidene]-1,3-thiazol-4-one Traditional Name: (5E)-2-(4-acetylpiperazino)-5-(4-tert-butylbenzylidene)-2-thiazolin-4-one Formula: C20H25N3O2S MolecularWeight: 371.4964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=NC(=O)C(=CC3=CC=C(C=C3)C(C)(C)C)S2

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=NC(=O)/C(=C\C3=CC=C(C=C3)C(C)(C)C)/S2

InChI

InChI=1S/C20H25N3O2S/c1-14(24)22-9-11-23(12-10-22)19-21-18(25)17(26-19)13-15-5-7-16(8-6-15)20(2,3)4/h5-8,13H,9-12H2,1-4H3/b17-13+