8-methyl-7-oxidanyl-4-[[2-(trifluoromethyl)quinazolin-4-yl]sulfanylmethyl]chromen-2-one

Systemtic Name: 8-methyl-7-oxidanyl-4-[[2-(trifluoromethyl)quinazolin-4-yl]sulfanylmethyl]chromen-2-one Openeye Name: 7-hydroxy-8-methyl-4-[[2-(trifluoromethyl)quinazolin-4-yl]sulfanylmethyl]chromen-2-one CAS Name: 7-hydroxy-8-methyl-4-[[[2-(trifluoromethyl)-4-quinazolinyl]thio]methyl]-1-benzopyran-2-one IUPAC Name: 7-hydroxy-8-methyl-4-[[2-(trifluoromethyl)quinazolin-4-yl]sulfanylmethyl]chromen-2-one Traditional Name: 7-hydroxy-8-methyl-4-[[[2-(trifluoromethyl)quinazolin-4-yl]thio]methyl]coumarin Formula: C20H13F3N2O3S MolecularWeight: 418.38903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2CSC3=NC(=NC4=CC=CC=C43)C(F)(F)F)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2CSC3=NC(=NC4=CC=CC=C43)C(F)(F)F)O

InChI

InChI=1S/C20H13F3N2O3S/c1-10-15(26)7-6-12-11(8-16(27)28-17(10)12)9-29-18-13-4-2-3-5-14(13)24-19(25-18)20(21,22)23/h2-8,26H,9H2,1H3