2-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]sulfanyl-6-morpholin-4-yl-3-(phenylmethyl)quinazolin-4-one

Systemtic Name: 2-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]sulfanyl-6-morpholin-4-yl-3-(phenylmethyl)quinazolin-4-one Openeye Name: 3-benzyl-2-[2-(4-fluorophenyl)-2-oxo-ethyl]sulfanyl-6-morpholino-quinazolin-4-one CAS Name: 2-[[2-(4-fluorophenyl)-2-oxoethyl]thio]-6-(4-morpholinyl)-3-(phenylmethyl)-4-quinazolinone IUPAC Name: 3-benzyl-2-[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl-6-morpholin-4-ylquinazolin-4-one Traditional Name: 3-benzyl-2-[[2-(4-fluorophenyl)-2-keto-ethyl]thio]-6-morpholino-quinazolin-4-one Formula: C27H24FN3O3S MolecularWeight: 489.561163

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC3=C(C=C2)N=C(N(C3=O)CC4=CC=CC=C4)SCC(=O)C5=CC=C(C=C5)F

Isomeric SMILES

C1COCCN1C2=CC3=C(C=C2)N=C(N(C3=O)CC4=CC=CC=C4)SCC(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C27H24FN3O3S/c28-21-8-6-20(7-9-21)25(32)18-35-27-29-24-11-10-22(30-12-14-34-15-13-30)16-23(24)26(33)31(27)17-19-4-2-1-3-5-19/h1-11,16H,12-15,17-18H2