6-fluoranyl-3-(2-methylpyridin-3-yl)-2-[(E)-2-(2-methyl-1,3-thiazol-4-yl)ethenyl]quinazolin-4-one; methanesulfonic acid

Systemtic Name: 6-fluoranyl-3-(2-methylpyridin-3-yl)-2-[(E)-2-(2-methyl-1,3-thiazol-4-yl)ethenyl]quinazolin-4-one; methanesulfonic acid Openeye Name: 6-fluoro-3-(2-methyl-3-pyridyl)-2-[(E)-2-(2-methylthiazol-4-yl)vinyl]quinazolin-4-one; methanesulfonic acid CAS Name: 6-fluoro-3-(2-methyl-3-pyridinyl)-2-[(E)-2-(2-methyl-4-thiazolyl)ethenyl]-4-quinazolinone; methanesulfonic acid IUPAC Name: 6-fluoro-3-(2-methylpyridin-3-yl)-2-[(E)-2-(2-methyl-1,3-thiazol-4-yl)ethenyl]quinazolin-4-one; methanesulfonic acid Traditional Name: 6-fluoro-3-(2-methyl-3-pyridyl)-2-[(E)-2-(2-methylthiazol-4-yl)vinyl]quinazolin-4-one; mesylic acid Formula: C21H19FN4O4S2 MolecularWeight: 474.528363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=N1)N2C(=NC3=C(C2=O)C=C(C=C3)F)C=CC4=CSC(=N4)C.CS(=O)(=O)O

Isomeric SMILES

CC1=C(C=CC=N1)N2C(=NC3=C(C2=O)C=C(C=C3)F)/C=C/C4=CSC(=N4)C.CS(=O)(=O)O

InChI

InChI=1S/C20H15FN4OS.CH4O3S/c1-12-18(4-3-9-22-12)25-19(8-6-15-11-27-13(2)23-15)24-17-7-5-14(21)10-16(17)20(25)26;1-5(2,3)4/h3-11H,1-2H3;1H3,(H,2,3,4)/b8-6+;