ethyl 2-[[2-methyl-5-(3-methyl-4-oxidanylidene-phthalazin-1-yl)phenyl]sulfonylamino]ethanoate

Systemtic Name: ethyl 2-[[2-methyl-5-(3-methyl-4-oxidanylidene-phthalazin-1-yl)phenyl]sulfonylamino]ethanoate Openeye Name: ethyl 2-[[2-methyl-5-(3-methyl-4-oxo-phthalazin-1-yl)phenyl]sulfonylamino]acetate CAS Name: 2-[[2-methyl-5-(3-methyl-4-oxo-1-phthalazinyl)phenyl]sulfonylamino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[2-methyl-5-(3-methyl-4-oxophthalazin-1-yl)phenyl]sulfonylamino]acetate Traditional Name: 2-[[5-(4-keto-3-methyl-phthalazin-1-yl)-2-methyl-phenyl]sulfonylamino]acetic acid ethyl ester Formula: C20H21N3O5S MolecularWeight: 415.46284

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNS(=O)(=O)C1=C(C=CC(=C1)C2=NN(C(=O)C3=CC=CC=C32)C)C

Isomeric SMILES

CCOC(=O)CNS(=O)(=O)C1=C(C=CC(=C1)C2=NN(C(=O)C3=CC=CC=C32)C)C

InChI

InChI=1S/C20H21N3O5S/c1-4-28-18(24)12-21-29(26,27)17-11-14(10-9-13(17)2)19-15-7-5-6-8-16(15)20(25)23(3)22-19/h5-11,21H,4,12H2,1-3H3