N-[4-(4-acetamido-2-fluoranyl-phenyl)-1,3-thiazol-2-yl]-2-(8-methyl-4-oxidanylidene-quinazolin-3-yl)ethanamide

Systemtic Name: N-[4-(4-acetamido-2-fluoranyl-phenyl)-1,3-thiazol-2-yl]-2-(8-methyl-4-oxidanylidene-quinazolin-3-yl)ethanamide Openeye Name: N-[4-(4-acetamido-2-fluoro-phenyl)thiazol-2-yl]-2-(8-methyl-4-oxo-quinazolin-3-yl)acetamide CAS Name: N-[4-(4-acetamido-2-fluorophenyl)-2-thiazolyl]-2-(8-methyl-4-oxo-3-quinazolinyl)acetamide IUPAC Name: N-[4-(4-acetamido-2-fluorophenyl)-1,3-thiazol-2-yl]-2-(8-methyl-4-oxoquinazolin-3-yl)acetamide Traditional Name: N-[4-(4-acetamido-2-fluoro-phenyl)thiazol-2-yl]-2-(4-keto-8-methyl-quinazolin-3-yl)acetamide Formula: C22H18FN5O3S MolecularWeight: 451.473423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=CN(C2=O)CC(=O)NC3=NC(=CS3)C4=C(C=C(C=C4)NC(=O)C)F

Isomeric SMILES

CC1=CC=CC2=C1N=CN(C2=O)CC(=O)NC3=NC(=CS3)C4=C(C=C(C=C4)NC(=O)C)F

InChI

InChI=1S/C22H18FN5O3S/c1-12-4-3-5-16-20(12)24-11-28(21(16)31)9-19(30)27-22-26-18(10-32-22)15-7-6-14(8-17(15)23)25-13(2)29/h3-8,10-11H,9H2,1-2H3,(H,25,29)(H,26,27,30)