4-oxidanylidene-3-pentyl-N-[3-[[5-(trifluoromethyl)pyridin-2-yl]amino]propyl]phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-3-pentyl-N-[3-[[5-(trifluoromethyl)pyridin-2-yl]amino]propyl]phthalazine-1-carboxamide Openeye Name: 4-oxo-3-pentyl-N-[3-[[5-(trifluoromethyl)-2-pyridyl]amino]propyl]phthalazine-1-carboxamide CAS Name: 4-oxo-3-pentyl-N-[3-[[5-(trifluoromethyl)-2-pyridinyl]amino]propyl]-1-phthalazinecarboxamide IUPAC Name: 4-oxo-3-pentyl-N-[3-[[5-(trifluoromethyl)pyridin-2-yl]amino]propyl]phthalazine-1-carboxamide Traditional Name: 3-amyl-4-keto-N-[3-[[5-(trifluoromethyl)-2-pyridyl]amino]propyl]phthalazine-1-carboxamide Formula: C23H26F3N5O2 MolecularWeight: 461.48005

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCCCNC3=NC=C(C=C3)C(F)(F)F

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCCCNC3=NC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C23H26F3N5O2/c1-2-3-6-14-31-22(33)18-9-5-4-8-17(18)20(30-31)21(32)28-13-7-12-27-19-11-10-16(15-29-19)23(24,25)26/h4-5,8-11,15H,2-3,6-7,12-14H2,1H3,(H,27,29)(H,28,32)