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

Systemtic Name: N-[4-(4-acetamido-2-fluoranyl-phenyl)-1,3-thiazol-2-yl]-3-(8-methyl-4-oxidanylidene-quinazolin-3-yl)propanamide Openeye Name: N-[4-(4-acetamido-2-fluoro-phenyl)thiazol-2-yl]-3-(8-methyl-4-oxo-quinazolin-3-yl)propanamide CAS Name: N-[4-(4-acetamido-2-fluorophenyl)-2-thiazolyl]-3-(8-methyl-4-oxo-3-quinazolinyl)propanamide IUPAC Name: N-[4-(4-acetamido-2-fluorophenyl)-1,3-thiazol-2-yl]-3-(8-methyl-4-oxoquinazolin-3-yl)propanamide Traditional Name: N-[4-(4-acetamido-2-fluoro-phenyl)thiazol-2-yl]-3-(4-keto-8-methyl-quinazolin-3-yl)propionamide Formula: C23H20FN5O3S MolecularWeight: 465.500003

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H20FN5O3S/c1-13-4-3-5-17-21(13)25-12-29(22(17)32)9-8-20(31)28-23-27-19(11-33-23)16-7-6-15(10-18(16)24)26-14(2)30/h3-7,10-12H,8-9H2,1-2H3,(H,26,30)(H,27,28,31)