4-methyl-3-phthalazin-6-yl-N-[4-(pyrrolidin-1-ylmethyl)-3-(trifluoromethyl)phenyl]benzamide

Systemtic Name: 4-methyl-3-phthalazin-6-yl-N-[4-(pyrrolidin-1-ylmethyl)-3-(trifluoromethyl)phenyl]benzamide Openeye Name: 4-methyl-3-phthalazin-6-yl-N-[4-(pyrrolidin-1-ylmethyl)-3-(trifluoromethyl)phenyl]benzamide CAS Name: 4-methyl-3-(6-phthalazinyl)-N-[4-(1-pyrrolidinylmethyl)-3-(trifluoromethyl)phenyl]benzamide IUPAC Name: 4-methyl-3-phthalazin-6-yl-N-[4-(pyrrolidin-1-ylmethyl)-3-(trifluoromethyl)phenyl]benzamide Traditional Name: 4-methyl-3-phthalazin-6-yl-N-[4-(pyrrolidinomethyl)-3-(trifluoromethyl)phenyl]benzamide Formula: C28H25F3N4O MolecularWeight: 490.51951

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC(=C(C=C2)CN3CCCC3)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)CN3CCCC3)C(F)(F)F)C4=CC5=CN=NC=C5C=C4

InChI

InChI=1S/C28H25F3N4O/c1-18-4-5-20(13-25(18)19-6-7-21-15-32-33-16-23(21)12-19)27(36)34-24-9-8-22(17-35-10-2-3-11-35)26(14-24)28(29,30)31/h4-9,12-16H,2-3,10-11,17H2,1H3,(H,34,36)