2-[(3,5-dimethylphenyl)amino]-5-[(5-methoxy-2-nitro-4-phenylmethoxy-phenyl)methylidene]-1,3-thiazol-4-one

Systemtic Name: 2-[(3,5-dimethylphenyl)amino]-5-[(5-methoxy-2-nitro-4-phenylmethoxy-phenyl)methylidene]-1,3-thiazol-4-one Openeye Name: 5-[(4-benzyloxy-5-methoxy-2-nitro-phenyl)methylene]-2-(3,5-dimethylanilino)thiazol-4-one CAS Name: 2-(3,5-dimethylanilino)-5-[(5-methoxy-2-nitro-4-phenylmethoxyphenyl)methylidene]-4-thiazolone IUPAC Name: 2-(3,5-dimethylanilino)-5-[(5-methoxy-2-nitro-4-phenylmethoxyphenyl)methylidene]-1,3-thiazol-4-one Traditional Name: 5-(4-benzoxy-5-methoxy-2-nitro-benzylidene)-2-(3,5-dimethylanilino)-2-thiazolin-4-one Formula: C26H23N3O5S MolecularWeight: 489.54292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC2=NC(=O)C(=CC3=CC(=C(C=C3[N+](=O)[O-])OCC4=CC=CC=C4)OC)S2)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC2=NC(=O)C(=CC3=CC(=C(C=C3[N+](=O)[O-])OCC4=CC=CC=C4)OC)S2)C

InChI

InChI=1S/C26H23N3O5S/c1-16-9-17(2)11-20(10-16)27-26-28-25(30)24(35-26)13-19-12-22(33-3)23(14-21(19)29(31)32)34-15-18-7-5-4-6-8-18/h4-14H,15H2,1-3H3,(H,27,28,30)