ethyl 2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanylethanoate

Systemtic Name: ethyl 2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanylethanoate Openeye Name: ethyl 2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanylacetate CAS Name: 2-[[4-(4-fluorophenyl)-1-phthalazinyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanylacetate Traditional Name: 2-[[4-(4-fluorophenyl)phthalazin-1-yl]thio]acetic acid ethyl ester Formula: C18H15FN2O2S MolecularWeight: 342.387303

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NN=C(C2=CC=CC=C21)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)CSC1=NN=C(C2=CC=CC=C21)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H15FN2O2S/c1-2-23-16(22)11-24-18-15-6-4-3-5-14(15)17(20-21-18)12-7-9-13(19)10-8-12/h3-10H,2,11H2,1H3