3-[[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]amino]-6,7-dimethoxy-3H-2-benzofuran-1-one

Systemtic Name: 3-[[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]amino]-6,7-dimethoxy-3H-2-benzofuran-1-one Openeye Name: 3-[[4-(2,4-dimethylphenyl)thiazol-2-yl]amino]-6,7-dimethoxy-3H-isobenzofuran-1-one CAS Name: 3-[[4-(2,4-dimethylphenyl)-2-thiazolyl]amino]-6,7-dimethoxy-3H-isobenzofuran-1-one IUPAC Name: 3-[[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]amino]-6,7-dimethoxy-3H-2-benzofuran-1-one Traditional Name: 3-[[4-(2,4-dimethylphenyl)thiazol-2-yl]amino]-6,7-dimethoxy-phthalide Formula: C21H20N2O4S MolecularWeight: 396.4595

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=CSC(=N2)NC3C4=C(C(=C(C=C4)OC)OC)C(=O)O3)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=CSC(=N2)NC3C4=C(C(=C(C=C4)OC)OC)C(=O)O3)C

InChI

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