6-azanyl-5-[2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanylethanoyl]-1,3-dimethyl-pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-5-[2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanylethanoyl]-1,3-dimethyl-pyrimidine-2,4-dione Openeye Name: 6-amino-5-[2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanylacetyl]-1,3-dimethyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-[2-[[4-(4-fluorophenyl)-1-phthalazinyl]thio]-1-oxoethyl]-1,3-dimethylpyrimidine-2,4-dione IUPAC Name: 6-amino-5-[2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanylacetyl]-1,3-dimethylpyrimidine-2,4-dione Traditional Name: 6-amino-5-[2-[[4-(4-fluorophenyl)phthalazin-1-yl]thio]acetyl]-1,3-dimethyl-pyrimidine-2,4-quinone Formula: C22H18FN5O3S MolecularWeight: 451.473423

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N(C1=O)C)C(=O)CSC2=NN=C(C3=CC=CC=C32)C4=CC=C(C=C4)F)N

Isomeric SMILES

CN1C(=C(C(=O)N(C1=O)C)C(=O)CSC2=NN=C(C3=CC=CC=C32)C4=CC=C(C=C4)F)N

InChI

InChI=1S/C22H18FN5O3S/c1-27-19(24)17(21(30)28(2)22(27)31)16(29)11-32-20-15-6-4-3-5-14(15)18(25-26-20)12-7-9-13(23)10-8-12/h3-10H,11,24H2,1-2H3