2-[(3-fluorophenyl)methylsulfanyl]-6-morpholin-4-yl-3-phenethyl-quinazolin-4-one

Systemtic Name: 2-[(3-fluorophenyl)methylsulfanyl]-6-morpholin-4-yl-3-phenethyl-quinazolin-4-one Openeye Name: 2-[(3-fluorophenyl)methylsulfanyl]-6-morpholino-3-phenethyl-quinazolin-4-one CAS Name: 2-[(3-fluorophenyl)methylthio]-6-(4-morpholinyl)-3-phenethyl-4-quinazolinone IUPAC Name: 2-[(3-fluorophenyl)methylsulfanyl]-6-morpholin-4-yl-3-phenethylquinazolin-4-one Traditional Name: 2-[(3-fluorobenzyl)thio]-6-morpholino-3-phenethyl-quinazolin-4-one Formula: C27H26FN3O2S MolecularWeight: 475.577643

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC3=C(C=C2)N=C(N(C3=O)CCC4=CC=CC=C4)SCC5=CC(=CC=C5)F

Isomeric SMILES

C1COCCN1C2=CC3=C(C=C2)N=C(N(C3=O)CCC4=CC=CC=C4)SCC5=CC(=CC=C5)F

InChI

InChI=1S/C27H26FN3O2S/c28-22-8-4-7-21(17-22)19-34-27-29-25-10-9-23(30-13-15-33-16-14-30)18-24(25)26(32)31(27)12-11-20-5-2-1-3-6-20/h1-10,17-18H,11-16,19H2