ethyl 2-[2-[4-(4-fluorophenyl)-1-oxidanylidene-phthalazin-2-yl]ethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[4-(4-fluorophenyl)-1-oxidanylidene-phthalazin-2-yl]ethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[4-(4-fluorophenyl)-1-oxo-phthalazin-2-yl]acetyl]amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[2-[4-(4-fluorophenyl)-1-oxo-2-phthalazinyl]-1-oxoethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[4-(4-fluorophenyl)-1-oxophthalazin-2-yl]acetyl]amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[[2-[4-(4-fluorophenyl)-1-keto-phthalazin-2-yl]acetyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C25H22FN3O4S MolecularWeight: 479.523283

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=C(C=C4)F

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H22FN3O4S/c1-4-33-25(32)21-14(2)15(3)34-23(21)27-20(30)13-29-24(31)19-8-6-5-7-18(19)22(28-29)16-9-11-17(26)12-10-16/h5-12H,4,13H2,1-3H3,(H,27,30)