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

Systemtic Name: 4-[[4-(4-methyl-3-sulfamoyl-phenyl)phthalazin-1-yl]amino]benzamide Openeye Name: 4-[[4-(4-methyl-3-sulfamoyl-phenyl)phthalazin-1-yl]amino]benzamide CAS Name: 4-[[4-(4-methyl-3-sulfamoylphenyl)-1-phthalazinyl]amino]benzamide IUPAC Name: 4-[[4-(4-methyl-3-sulfamoylphenyl)phthalazin-1-yl]amino]benzamide Traditional Name: 4-[[4-(4-methyl-3-sulfamoyl-phenyl)phthalazin-1-yl]amino]benzamide Formula: C22H19N5O3S MolecularWeight: 433.48296

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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)N

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)N

InChI

InChI=1S/C22H19N5O3S/c1-13-6-7-15(12-19(13)31(24,29)30)20-17-4-2-3-5-18(17)22(27-26-20)25-16-10-8-14(9-11-16)21(23)28/h2-12H,1H3,(H2,23,28)(H,25,27)(H2,24,29,30)