4-[[4-[3-[(4-hydroxyphenyl)sulfamoyl]-4-methyl-phenyl]phthalazin-1-yl]amino]benzamide

Systemtic Name: 4-[[4-[3-[(4-hydroxyphenyl)sulfamoyl]-4-methyl-phenyl]phthalazin-1-yl]amino]benzamide Openeye Name: 4-[[4-[3-[(4-hydroxyphenyl)sulfamoyl]-4-methyl-phenyl]phthalazin-1-yl]amino]benzamide CAS Name: 4-[[4-[3-[(4-hydroxyphenyl)sulfamoyl]-4-methylphenyl]-1-phthalazinyl]amino]benzamide IUPAC Name: 4-[[4-[3-[(4-hydroxyphenyl)sulfamoyl]-4-methylphenyl]phthalazin-1-yl]amino]benzamide Traditional Name: 4-[[4-[3-[(4-hydroxyphenyl)sulfamoyl]-4-methyl-phenyl]phthalazin-1-yl]amino]benzamide Formula: C28H23N5O4S MolecularWeight: 525.57832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC=C(C=C4)C(=O)N)S(=O)(=O)NC5=CC=C(C=C5)O

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC=C(C=C4)C(=O)N)S(=O)(=O)NC5=CC=C(C=C5)O

InChI

InChI=1S/C28H23N5O4S/c1-17-6-7-19(16-25(17)38(36,37)33-21-12-14-22(34)15-13-21)26-23-4-2-3-5-24(23)28(32-31-26)30-20-10-8-18(9-11-20)27(29)35/h2-16,33-34H,1H3,(H2,29,35)(H,30,32)