1-methyl-4-[4-[4-(4-methylphthalazin-1-yl)oxyphenyl]sulfonylphenoxy]phthalazine

Systemtic Name: 1-methyl-4-[4-[4-(4-methylphthalazin-1-yl)oxyphenyl]sulfonylphenoxy]phthalazine Openeye Name: 1-methyl-4-[4-[4-(4-methylphthalazin-1-yl)oxyphenyl]sulfonylphenoxy]phthalazine CAS Name: 1-methyl-4-[4-[4-[(4-methyl-1-phthalazinyl)oxy]phenyl]sulfonylphenoxy]phthalazine IUPAC Name: 1-methyl-4-[4-[4-(4-methylphthalazin-1-yl)oxyphenyl]sulfonylphenoxy]phthalazine Traditional Name: 1-methyl-4-[4-[4-(4-methylphthalazin-1-yl)oxyphenyl]sulfonylphenoxy]phthalazine Formula: C30H22N4O4S MolecularWeight: 534.58508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(C2=CC=CC=C12)OC3=CC=C(C=C3)S(=O)(=O)C4=CC=C(C=C4)OC5=NN=C(C6=CC=CC=C65)C

Isomeric SMILES

CC1=NN=C(C2=CC=CC=C12)OC3=CC=C(C=C3)S(=O)(=O)C4=CC=C(C=C4)OC5=NN=C(C6=CC=CC=C65)C

InChI

InChI=1S/C30H22N4O4S/c1-19-25-7-3-5-9-27(25)29(33-31-19)37-21-11-15-23(16-12-21)39(35,36)24-17-13-22(14-18-24)38-30-28-10-6-4-8-26(28)20(2)32-34-30/h3-18H,1-2H3