1-(4-chlorophenyl)-2-[4-[(4-fluorophenyl)amino]quinazolin-2-yl]sulfanyl-ethanone

Systemtic Name: 1-(4-chlorophenyl)-2-[4-[(4-fluorophenyl)amino]quinazolin-2-yl]sulfanyl-ethanone Openeye Name: 1-(4-chlorophenyl)-2-[4-(4-fluoroanilino)quinazolin-2-yl]sulfanyl-ethanone CAS Name: 1-(4-chlorophenyl)-2-[[4-(4-fluoroanilino)-2-quinazolinyl]thio]ethanone IUPAC Name: 1-(4-chlorophenyl)-2-[4-(4-fluoroanilino)quinazolin-2-yl]sulfanylethanone Traditional Name: 1-(4-chlorophenyl)-2-[[4-(4-fluoroanilino)quinazolin-2-yl]thio]ethanone Formula: C22H15ClFN3OS MolecularWeight: 423.890403

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)SCC(=O)C3=CC=C(C=C3)Cl)NC4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)SCC(=O)C3=CC=C(C=C3)Cl)NC4=CC=C(C=C4)F

InChI

InChI=1S/C22H15ClFN3OS/c23-15-7-5-14(6-8-15)20(28)13-29-22-26-19-4-2-1-3-18(19)21(27-22)25-17-11-9-16(24)10-12-17/h1-12H,13H2,(H,25,26,27)