methyl 2-[2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanylethanoylamino]ethanoate

Systemtic Name: methyl 2-[2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanylethanoylamino]ethanoate Openeye Name: methyl 2-[[2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanylacetyl]amino]acetate CAS Name: 2-[[2-[[4-(4-fluorophenyl)-1-phthalazinyl]thio]-1-oxoethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanylacetyl]amino]acetate Traditional Name: 2-[[2-[[4-(4-fluorophenyl)phthalazin-1-yl]thio]acetyl]amino]acetic acid methyl ester Formula: C19H16FN3O3S MolecularWeight: 385.412043

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16FN3O3S/c1-26-17(25)10-21-16(24)11-27-19-15-5-3-2-4-14(15)18(22-23-19)12-6-8-13(20)9-7-12/h2-9H,10-11H2,1H3,(H,21,24)