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

Systemtic Name: [6-ethyl-4-oxidanylidene-3-(5-phenyl-1,3,4-thiadiazol-2-yl)-2-(trifluoromethyl)chromen-7-yl] ethanoate Openeye Name: [6-ethyl-4-oxo-3-(5-phenyl-1,3,4-thiadiazol-2-yl)-2-(trifluoromethyl)chromen-7-yl] acetate CAS Name: acetic acid [6-ethyl-4-oxo-3-(5-phenyl-1,3,4-thiadiazol-2-yl)-2-(trifluoromethyl)-1-benzopyran-7-yl] ester IUPAC Name: [6-ethyl-4-oxo-3-(5-phenyl-1,3,4-thiadiazol-2-yl)-2-(trifluoromethyl)chromen-7-yl] acetate Traditional Name: acetic acid [6-ethyl-4-keto-3-(5-phenyl-1,3,4-thiadiazol-2-yl)-2-(trifluoromethyl)chromen-7-yl] ester Formula: C22H15F3N2O4S MolecularWeight: 460.42571

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C(F)(F)F)C3=NN=C(S3)C4=CC=CC=C4)OC(=O)C

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C(F)(F)F)C3=NN=C(S3)C4=CC=CC=C4)OC(=O)C

InChI

InChI=1S/C22H15F3N2O4S/c1-3-12-9-14-16(10-15(12)30-11(2)28)31-19(22(23,24)25)17(18(14)29)21-27-26-20(32-21)13-7-5-4-6-8-13/h4-10H,3H2,1-2H3