6-ethyl-3-(2-methyl-1,3-thiazol-4-yl)-7-phenylmethoxy-2-(trifluoromethyl)chromen-4-one

Systemtic Name: 6-ethyl-3-(2-methyl-1,3-thiazol-4-yl)-7-phenylmethoxy-2-(trifluoromethyl)chromen-4-one Openeye Name: 7-benzyloxy-6-ethyl-3-(2-methylthiazol-4-yl)-2-(trifluoromethyl)chromen-4-one CAS Name: 6-ethyl-3-(2-methyl-4-thiazolyl)-7-phenylmethoxy-2-(trifluoromethyl)-1-benzopyran-4-one IUPAC Name: 6-ethyl-3-(2-methyl-1,3-thiazol-4-yl)-7-phenylmethoxy-2-(trifluoromethyl)chromen-4-one Traditional Name: 7-benzoxy-6-ethyl-3-(2-methylthiazol-4-yl)-2-(trifluoromethyl)chromone Formula: C23H18F3NO3S MolecularWeight: 445.45413

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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=CSC(=N3)C)OCC4=CC=CC=C4

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C(F)(F)F)C3=CSC(=N3)C)OCC4=CC=CC=C4

InChI

InChI=1S/C23H18F3NO3S/c1-3-15-9-16-19(10-18(15)29-11-14-7-5-4-6-8-14)30-22(23(24,25)26)20(21(16)28)17-12-31-13(2)27-17/h4-10,12H,3,11H2,1-2H3