ethyl 2-[6-ethyl-4-oxidanylidene-3-(1,3-thiazol-4-yl)chromen-7-yl]oxy-3-methyl-butanoate

Systemtic Name: ethyl 2-[6-ethyl-4-oxidanylidene-3-(1,3-thiazol-4-yl)chromen-7-yl]oxy-3-methyl-butanoate Openeye Name: ethyl 2-(6-ethyl-4-oxo-3-thiazol-4-yl-chromen-7-yl)oxy-3-methyl-butanoate CAS Name: 2-[[6-ethyl-4-oxo-3-(4-thiazolyl)-1-benzopyran-7-yl]oxy]-3-methylbutanoic acid ethyl ester IUPAC Name: ethyl 2-[6-ethyl-4-oxo-3-(1,3-thiazol-4-yl)chromen-7-yl]oxy-3-methylbutanoate Traditional Name: 2-(6-ethyl-4-keto-3-thiazol-4-yl-chromen-7-yl)oxy-3-methyl-butyric acid ethyl ester Formula: C21H23NO5S MolecularWeight: 401.47602

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CSC=N3)OC(C(C)C)C(=O)OCC

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CSC=N3)OC(C(C)C)C(=O)OCC

InChI

InChI=1S/C21H23NO5S/c1-5-13-7-14-18(26-9-15(19(14)23)16-10-28-11-22-16)8-17(13)27-20(12(3)4)21(24)25-6-2/h7-12,20H,5-6H2,1-4H3