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

Systemtic Name: 6-butyl-3-(4-methyl-1,3-thiazol-2-yl)-7-oxidanyl-2-(trifluoromethyl)chromen-4-one Openeye Name: 6-butyl-7-hydroxy-3-(4-methylthiazol-2-yl)-2-(trifluoromethyl)chromen-4-one CAS Name: 6-butyl-7-hydroxy-3-(4-methyl-2-thiazolyl)-2-(trifluoromethyl)-1-benzopyran-4-one IUPAC Name: 6-butyl-7-hydroxy-3-(4-methyl-1,3-thiazol-2-yl)-2-(trifluoromethyl)chromen-4-one Traditional Name: 6-butyl-7-hydroxy-3-(4-methylthiazol-2-yl)-2-(trifluoromethyl)chromone Formula: C18H16F3NO3S MolecularWeight: 383.38475

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C(F)(F)F)C3=NC(=CS3)C)O

Isomeric SMILES

CCCCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C(F)(F)F)C3=NC(=CS3)C)O

InChI

InChI=1S/C18H16F3NO3S/c1-3-4-5-10-6-11-13(7-12(10)23)25-16(18(19,20)21)14(15(11)24)17-22-9(2)8-26-17/h6-8,23H,3-5H2,1-2H3