[2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl 3-(4-oxidanylidenequinazolin-3-yl)propanoate

Systemtic Name: [2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl 3-(4-oxidanylidenequinazolin-3-yl)propanoate Openeye Name: [2-(4-fluorophenyl)thiazol-4-yl]methyl 3-(4-oxoquinazolin-3-yl)propanoate CAS Name: 3-(4-oxo-3-quinazolinyl)propanoic acid [2-(4-fluorophenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl 3-(4-oxoquinazolin-3-yl)propanoate Traditional Name: 3-(4-ketoquinazolin-3-yl)propionic acid [2-(4-fluorophenyl)thiazol-4-yl]methyl ester Formula: C21H16FN3O3S MolecularWeight: 409.433443

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C=N2)CCC(=O)OCC3=CSC(=N3)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C=N2)CCC(=O)OCC3=CSC(=N3)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H16FN3O3S/c22-15-7-5-14(6-8-15)20-24-16(12-29-20)11-28-19(26)9-10-25-13-23-18-4-2-1-3-17(18)21(25)27/h1-8,12-13H,9-11H2