7-oxidanyl-4-[[5-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]chromen-2-one

Systemtic Name: 7-oxidanyl-4-[[5-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]chromen-2-one Openeye Name: 7-hydroxy-4-[[5-(trifluoromethyl)-2-pyridyl]sulfanylmethyl]chromen-2-one CAS Name: 7-hydroxy-4-[[[5-(trifluoromethyl)-2-pyridinyl]thio]methyl]-1-benzopyran-2-one IUPAC Name: 7-hydroxy-4-[[5-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]chromen-2-one Traditional Name: 7-hydroxy-4-[[[5-(trifluoromethyl)-2-pyridyl]thio]methyl]coumarin Formula: C16H10F3NO3S MolecularWeight: 353.31571

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1O)OC(=O)C=C2CSC3=NC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1=CC2=C(C=C1O)OC(=O)C=C2CSC3=NC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C16H10F3NO3S/c17-16(18,19)10-1-4-14(20-7-10)24-8-9-5-15(22)23-13-6-11(21)2-3-12(9)13/h1-7,21H,8H2