butyl 3-[3-(2-fluorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanoate

Systemtic Name: butyl 3-[3-(2-fluorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanoate Openeye Name: butyl 3-[3-(2-fluorophenyl)-4-oxo-quinazolin-2-yl]sulfanylpropanoate CAS Name: 3-[[3-(2-fluorophenyl)-4-oxo-2-quinazolinyl]thio]propanoic acid butyl ester IUPAC Name: butyl 3-[3-(2-fluorophenyl)-4-oxoquinazolin-2-yl]sulfanylpropanoate Traditional Name: 3-[[3-(2-fluorophenyl)-4-keto-quinazolin-2-yl]thio]propionic acid butyl ester Formula: C21H21FN2O3S MolecularWeight: 400.466443

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CCSC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3F

Isomeric SMILES

CCCCOC(=O)CCSC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3F

InChI

InChI=1S/C21H21FN2O3S/c1-2-3-13-27-19(25)12-14-28-21-23-17-10-6-4-8-15(17)20(26)24(21)18-11-7-5-9-16(18)22/h4-11H,2-3,12-14H2,1H3