ethyl 2-[[2-methyl-5-(4-phenylazanylphthalazin-1-yl)phenyl]sulfonylamino]ethanoate

Systemtic Name: ethyl 2-[[2-methyl-5-(4-phenylazanylphthalazin-1-yl)phenyl]sulfonylamino]ethanoate Openeye Name: ethyl 2-[[5-(4-anilinophthalazin-1-yl)-2-methyl-phenyl]sulfonylamino]acetate CAS Name: 2-[[5-(4-anilino-1-phthalazinyl)-2-methylphenyl]sulfonylamino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[5-(4-anilinophthalazin-1-yl)-2-methylphenyl]sulfonylamino]acetate Traditional Name: 2-[[5-(4-anilinophthalazin-1-yl)-2-methyl-phenyl]sulfonylamino]acetic acid ethyl ester Formula: C25H24N4O4S MolecularWeight: 476.54746

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNS(=O)(=O)C1=C(C=CC(=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)CNS(=O)(=O)C1=C(C=CC(=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC=CC=C4)C

InChI

InChI=1S/C25H24N4O4S/c1-3-33-23(30)16-26-34(31,32)22-15-18(14-13-17(22)2)24-20-11-7-8-12-21(20)25(29-28-24)27-19-9-5-4-6-10-19/h4-15,26H,3,16H2,1-2H3,(H,27,29)