3-(5-methylpyridin-2-yl)-2-[2,2,2-tris(fluoranyl)ethylsulfanyl]quinazolin-4-one

Systemtic Name: 3-(5-methylpyridin-2-yl)-2-[2,2,2-tris(fluoranyl)ethylsulfanyl]quinazolin-4-one Openeye Name: 3-(5-methyl-2-pyridyl)-2-(2,2,2-trifluoroethylsulfanyl)quinazolin-4-one CAS Name: 3-(5-methyl-2-pyridinyl)-2-(2,2,2-trifluoroethylthio)-4-quinazolinone IUPAC Name: 3-(5-methylpyridin-2-yl)-2-(2,2,2-trifluoroethylsulfanyl)quinazolin-4-one Traditional Name: 3-(5-methyl-2-pyridyl)-2-(2,2,2-trifluoroethylthio)quinazolin-4-one Formula: C16H12F3N3OS MolecularWeight: 351.34619

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(F)(F)F

Isomeric SMILES

CC1=CN=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(F)(F)F

InChI

InChI=1S/C16H12F3N3OS/c1-10-6-7-13(20-8-10)22-14(23)11-4-2-3-5-12(11)21-15(22)24-9-16(17,18)19/h2-8H,9H2,1H3