6-chloranyl-2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-3-(2-methylpropyl)quinazolin-4-one

Systemtic Name: 6-chloranyl-2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-3-(2-methylpropyl)quinazolin-4-one Openeye Name: 6-chloro-2-[(3-fluoro-4-methoxy-phenyl)methylsulfanyl]-3-isobutyl-quinazolin-4-one CAS Name: 6-chloro-2-[(3-fluoro-4-methoxyphenyl)methylthio]-3-(2-methylpropyl)-4-quinazolinone IUPAC Name: 6-chloro-2-[(3-fluoro-4-methoxyphenyl)methylsulfanyl]-3-(2-methylpropyl)quinazolin-4-one Traditional Name: 6-chloro-2-[(3-fluoro-4-methoxy-benzyl)thio]-3-isobutyl-quinazolin-4-one Formula: C20H20ClFN2O2S MolecularWeight: 406.901403

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C=CC(=C2)Cl)N=C1SCC3=CC(=C(C=C3)OC)F

Isomeric SMILES

CC(C)CN1C(=O)C2=C(C=CC(=C2)Cl)N=C1SCC3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C20H20ClFN2O2S/c1-12(2)10-24-19(25)15-9-14(21)5-6-17(15)23-20(24)27-11-13-4-7-18(26-3)16(22)8-13/h4-9,12H,10-11H2,1-3H3