2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-3-(3-fluorophenyl)-7-pyrrolidin-1-ylcarbonyl-quinazolin-4-one

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-3-(3-fluorophenyl)-7-pyrrolidin-1-ylcarbonyl-quinazolin-4-one Openeye Name: 2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-3-(3-fluorophenyl)-7-(pyrrolidine-1-carbonyl)quinazolin-4-one CAS Name: 2-[(2-chloro-6-fluorophenyl)methylthio]-3-(3-fluorophenyl)-7-[oxo(1-pyrrolidinyl)methyl]-4-quinazolinone IUPAC Name: 2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-3-(3-fluorophenyl)-7-(pyrrolidine-1-carbonyl)quinazolin-4-one Traditional Name: 2-[(2-chloro-6-fluoro-benzyl)thio]-3-(3-fluorophenyl)-7-(pyrrolidine-1-carbonyl)quinazolin-4-one Formula: C26H20ClF2N3O2S MolecularWeight: 511.970706

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC3=C(C=C2)C(=O)N(C(=N3)SCC4=C(C=CC=C4Cl)F)C5=CC(=CC=C5)F

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC3=C(C=C2)C(=O)N(C(=N3)SCC4=C(C=CC=C4Cl)F)C5=CC(=CC=C5)F

InChI

InChI=1S/C26H20ClF2N3O2S/c27-21-7-4-8-22(29)20(21)15-35-26-30-23-13-16(24(33)31-11-1-2-12-31)9-10-19(23)25(34)32(26)18-6-3-5-17(28)14-18/h3-10,13-14H,1-2,11-12,15H2