1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl 3-[3,4-bis(fluoranyl)phenyl]sulfanylpropanoate

Systemtic Name: 1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl 3-[3,4-bis(fluoranyl)phenyl]sulfanylpropanoate Openeye Name: 1-(4-oxo-1H-quinazolin-2-yl)ethyl 3-(3,4-difluorophenyl)sulfanylpropanoate CAS Name: 3-[(3,4-difluorophenyl)thio]propanoic acid 1-(4-oxo-1H-quinazolin-2-yl)ethyl ester IUPAC Name: 1-(4-oxo-1H-quinazolin-2-yl)ethyl 3-(3,4-difluorophenyl)sulfanylpropanoate Traditional Name: 3-[(3,4-difluorophenyl)thio]propionic acid 1-(4-keto-1H-quinazolin-2-yl)ethyl ester Formula: C19H16F2N2O3S MolecularWeight: 390.403746

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=O)C2=CC=CC=C2N1)OC(=O)CCSC3=CC(=C(C=C3)F)F

Isomeric SMILES

CC(C1=NC(=O)C2=CC=CC=C2N1)OC(=O)CCSC3=CC(=C(C=C3)F)F

InChI

InChI=1S/C19H16F2N2O3S/c1-11(18-22-16-5-3-2-4-13(16)19(25)23-18)26-17(24)8-9-27-12-6-7-14(20)15(21)10-12/h2-7,10-11H,8-9H2,1H3,(H,22,23,25)