2-[(2,4-dimethylphenyl)amino]-5-[(6-ethoxy-1,3-benzodioxol-5-yl)methylidene]-1,3-thiazol-4-one

Systemtic Name: 2-[(2,4-dimethylphenyl)amino]-5-[(6-ethoxy-1,3-benzodioxol-5-yl)methylidene]-1,3-thiazol-4-one Openeye Name: 2-(2,4-dimethylanilino)-5-[(6-ethoxy-1,3-benzodioxol-5-yl)methylene]thiazol-4-one CAS Name: 2-(2,4-dimethylanilino)-5-[(6-ethoxy-1,3-benzodioxol-5-yl)methylidene]-4-thiazolone IUPAC Name: 2-(2,4-dimethylanilino)-5-[(6-ethoxy-1,3-benzodioxol-5-yl)methylidene]-1,3-thiazol-4-one Traditional Name: 2-(2,4-dimethylanilino)-5-[(6-ethoxy-1,3-benzodioxol-5-yl)methylene]-2-thiazolin-4-one Formula: C21H20N2O4S MolecularWeight: 396.4595

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1C=C3C(=O)N=C(S3)NC4=C(C=C(C=C4)C)C)OCO2

Isomeric SMILES

CCOC1=CC2=C(C=C1C=C3C(=O)N=C(S3)NC4=C(C=C(C=C4)C)C)OCO2

InChI

InChI=1S/C21H20N2O4S/c1-4-25-16-10-18-17(26-11-27-18)8-14(16)9-19-20(24)23-21(28-19)22-15-6-5-12(2)7-13(15)3/h5-10H,4,11H2,1-3H3,(H,22,23,24)