2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-3-(1-methoxypropan-2-yl)quinazolin-4-one

Systemtic Name: 2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-3-(1-methoxypropan-2-yl)quinazolin-4-one Openeye Name: 2-[(3-fluoro-4-methoxy-phenyl)methylsulfanyl]-3-(2-methoxy-1-methyl-ethyl)quinazolin-4-one CAS Name: 2-[(3-fluoro-4-methoxyphenyl)methylthio]-3-(1-methoxypropan-2-yl)-4-quinazolinone IUPAC Name: 2-[(3-fluoro-4-methoxyphenyl)methylsulfanyl]-3-(1-methoxypropan-2-yl)quinazolin-4-one Traditional Name: 2-[(3-fluoro-4-methoxy-benzyl)thio]-3-(2-methoxy-1-methyl-ethyl)quinazolin-4-one Formula: C20H21FN2O3S MolecularWeight: 388.455743

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)N1C(=O)C2=CC=CC=C2N=C1SCC3=CC(=C(C=C3)OC)F

Isomeric SMILES

CC(COC)N1C(=O)C2=CC=CC=C2N=C1SCC3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C20H21FN2O3S/c1-13(11-25-2)23-19(24)15-6-4-5-7-17(15)22-20(23)27-12-14-8-9-18(26-3)16(21)10-14/h4-10,13H,11-12H2,1-3H3