6,8-bis(bromanyl)-2-[[5-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 6,8-bis(bromanyl)-2-[[5-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 6,8-dibromo-2-[[5-(trifluoromethyl)-2-pyridyl]sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 6,8-dibromo-2-[[[5-(trifluoromethyl)-2-pyridinyl]thio]methyl]-1H-quinazolin-4-one IUPAC Name: 6,8-dibromo-2-[[5-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 6,8-dibromo-2-[[[5-(trifluoromethyl)-2-pyridyl]thio]methyl]-1H-quinazolin-4-one Formula: C15H8Br2F3N3OS MolecularWeight: 495.11173

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC=C1C(F)(F)F)SCC2=NC(=O)C3=CC(=CC(=C3N2)Br)Br

Isomeric SMILES

C1=CC(=NC=C1C(F)(F)F)SCC2=NC(=O)C3=CC(=CC(=C3N2)Br)Br

InChI

InChI=1S/C15H8Br2F3N3OS/c16-8-3-9-13(10(17)4-8)22-11(23-14(9)24)6-25-12-2-1-7(5-21-12)15(18,19)20/h1-5H,6H2,(H,22,23,24)