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

Systemtic Name: N-methyl-4-[[4-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)phthalazin-1-yl]amino]benzamide Openeye Name: N-methyl-4-[[4-(4-methyl-3-morpholinosulfonyl-phenyl)phthalazin-1-yl]amino]benzamide CAS Name: N-methyl-4-[[4-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]-1-phthalazinyl]amino]benzamide IUPAC Name: N-methyl-4-[[4-(4-methyl-3-morpholin-4-ylsulfonylphenyl)phthalazin-1-yl]amino]benzamide Traditional Name: N-methyl-4-[[4-(4-methyl-3-morpholinosulfonyl-phenyl)phthalazin-1-yl]amino]benzamide Formula: C27H27N5O4S MolecularWeight: 517.59938

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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)NC)S(=O)(=O)N5CCOCC5

Isomeric SMILES

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

InChI

InChI=1S/C27H27N5O4S/c1-18-7-8-20(17-24(18)37(34,35)32-13-15-36-16-14-32)25-22-5-3-4-6-23(22)26(31-30-25)29-21-11-9-19(10-12-21)27(33)28-2/h3-12,17H,13-16H2,1-2H3,(H,28,33)(H,29,31)