4-methyl-N-[4-(morpholin-4-ylmethyl)-3-(trifluoromethyl)phenyl]-3-phthalazin-6-yl-benzamide

Systemtic Name: 4-methyl-N-[4-(morpholin-4-ylmethyl)-3-(trifluoromethyl)phenyl]-3-phthalazin-6-yl-benzamide Openeye Name: 4-methyl-N-[4-(morpholinomethyl)-3-(trifluoromethyl)phenyl]-3-phthalazin-6-yl-benzamide CAS Name: 4-methyl-N-[4-(4-morpholinylmethyl)-3-(trifluoromethyl)phenyl]-3-(6-phthalazinyl)benzamide IUPAC Name: 4-methyl-N-[4-(morpholin-4-ylmethyl)-3-(trifluoromethyl)phenyl]-3-phthalazin-6-ylbenzamide Traditional Name: 4-methyl-N-[4-(morpholinomethyl)-3-(trifluoromethyl)phenyl]-3-phthalazin-6-yl-benzamide Formula: C28H25F3N4O2 MolecularWeight: 506.51891

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC(=C(C=C2)CN3CCOCC3)C(F)(F)F)C4=CC5=CN=NC=C5C=C4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC(=C(C=C2)CN3CCOCC3)C(F)(F)F)C4=CC5=CN=NC=C5C=C4

InChI

InChI=1S/C28H25F3N4O2/c1-18-2-3-20(13-25(18)19-4-5-21-15-32-33-16-23(21)12-19)27(36)34-24-7-6-22(26(14-24)28(29,30)31)17-35-8-10-37-11-9-35/h2-7,12-16H,8-11,17H2,1H3,(H,34,36)