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

Systemtic Name: 2-[(3,5-dimethylphenyl)amino]-5-[(6-methoxy-1,3-benzodioxol-5-yl)methylidene]-1,3-thiazol-4-one Openeye Name: 2-(3,5-dimethylanilino)-5-[(6-methoxy-1,3-benzodioxol-5-yl)methylene]thiazol-4-one CAS Name: 2-(3,5-dimethylanilino)-5-[(6-methoxy-1,3-benzodioxol-5-yl)methylidene]-4-thiazolone IUPAC Name: 2-(3,5-dimethylanilino)-5-[(6-methoxy-1,3-benzodioxol-5-yl)methylidene]-1,3-thiazol-4-one Traditional Name: 2-(3,5-dimethylanilino)-5-[(6-methoxy-1,3-benzodioxol-5-yl)methylene]-2-thiazolin-4-one Formula: C20H18N2O4S MolecularWeight: 382.43292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC2=NC(=O)C(=CC3=CC4=C(C=C3OC)OCO4)S2)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC2=NC(=O)C(=CC3=CC4=C(C=C3OC)OCO4)S2)C

InChI

InChI=1S/C20H18N2O4S/c1-11-4-12(2)6-14(5-11)21-20-22-19(23)18(27-20)8-13-7-16-17(26-10-25-16)9-15(13)24-3/h4-9H,10H2,1-3H3,(H,21,22,23)