ethyl 2-[6-ethyl-4-oxidanylidene-3-(5-phenyl-1,3,4-thiadiazol-2-yl)chromen-7-yl]oxyethanoate

Systemtic Name: ethyl 2-[6-ethyl-4-oxidanylidene-3-(5-phenyl-1,3,4-thiadiazol-2-yl)chromen-7-yl]oxyethanoate Openeye Name: ethyl 2-[6-ethyl-4-oxo-3-(5-phenyl-1,3,4-thiadiazol-2-yl)chromen-7-yl]oxyacetate CAS Name: 2-[[6-ethyl-4-oxo-3-(5-phenyl-1,3,4-thiadiazol-2-yl)-1-benzopyran-7-yl]oxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[6-ethyl-4-oxo-3-(5-phenyl-1,3,4-thiadiazol-2-yl)chromen-7-yl]oxyacetate Traditional Name: 2-[6-ethyl-4-keto-3-(5-phenyl-1,3,4-thiadiazol-2-yl)chromen-7-yl]oxyacetic acid ethyl ester Formula: C23H20N2O5S MolecularWeight: 436.4803

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=NN=C(S3)C4=CC=CC=C4)OCC(=O)OCC

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=NN=C(S3)C4=CC=CC=C4)OCC(=O)OCC

InChI

InChI=1S/C23H20N2O5S/c1-3-14-10-16-19(11-18(14)30-13-20(26)28-4-2)29-12-17(21(16)27)23-25-24-22(31-23)15-8-6-5-7-9-15/h5-12H,3-4,13H2,1-2H3