2-[[3-(4-fluorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethylsulfanyl]-N-phenethyl-ethanamide

Systemtic Name: 2-[[3-(4-fluorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethylsulfanyl]-N-phenethyl-ethanamide Openeye Name: 2-[[3-(4-fluorophenyl)-4-oxo-quinazolin-2-yl]sulfanylmethylsulfanyl]-N-phenethyl-acetamide CAS Name: 2-[[[3-(4-fluorophenyl)-4-oxo-2-quinazolinyl]thio]methylthio]-N-phenethylacetamide IUPAC Name: 2-[[3-(4-fluorophenyl)-4-oxoquinazolin-2-yl]sulfanylmethylsulfanyl]-N-phenethylacetamide Traditional Name: 2-[[[3-(4-fluorophenyl)-4-keto-quinazolin-2-yl]thio]methylthio]-N-phenethyl-acetamide Formula: C25H22FN3O2S2 MolecularWeight: 479.589483

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)CSCSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)CSCSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)F

InChI

InChI=1S/C25H22FN3O2S2/c26-19-10-12-20(13-11-19)29-24(31)21-8-4-5-9-22(21)28-25(29)33-17-32-16-23(30)27-15-14-18-6-2-1-3-7-18/h1-13H,14-17H2,(H,27,30)