2-methoxy-5-[[4-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)phthalazin-1-yl]amino]benzamide

Systemtic Name: 2-methoxy-5-[[4-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)phthalazin-1-yl]amino]benzamide Openeye Name: 2-methoxy-5-[[4-(4-methyl-3-morpholinosulfonyl-phenyl)phthalazin-1-yl]amino]benzamide CAS Name: 2-methoxy-5-[[4-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]-1-phthalazinyl]amino]benzamide IUPAC Name: 2-methoxy-5-[[4-(4-methyl-3-morpholin-4-ylsulfonylphenyl)phthalazin-1-yl]amino]benzamide Traditional Name: 2-methoxy-5-[[4-(4-methyl-3-morpholinosulfonyl-phenyl)phthalazin-1-yl]amino]benzamide Formula: C27H27N5O5S MolecularWeight: 533.59878

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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)OC)C(=O)N)S(=O)(=O)N5CCOCC5

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC(=C(C=C4)OC)C(=O)N)S(=O)(=O)N5CCOCC5

InChI

InChI=1S/C27H27N5O5S/c1-17-7-8-18(15-24(17)38(34,35)32-11-13-37-14-12-32)25-20-5-3-4-6-21(20)27(31-30-25)29-19-9-10-23(36-2)22(16-19)26(28)33/h3-10,15-16H,11-14H2,1-2H3,(H2,28,33)(H,29,31)