N-[2-[[2,6-bis(fluoranyl)phenyl]amino]-2-oxidanylidene-ethyl]-N-ethyl-3-hexyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[2-[[2,6-bis(fluoranyl)phenyl]amino]-2-oxidanylidene-ethyl]-N-ethyl-3-hexyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[2-(2,6-difluoroanilino)-2-oxo-ethyl]-N-ethyl-3-hexyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-3-hexyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-3-hexyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[2-(2,6-difluoroanilino)-2-keto-ethyl]-N-ethyl-3-hexyl-4-keto-phthalazine-1-carboxamide Formula: C25H28F2N4O3 MolecularWeight: 470.511626

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N(CC)CC(=O)NC3=C(C=CC=C3F)F

Isomeric SMILES

CCCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N(CC)CC(=O)NC3=C(C=CC=C3F)F

InChI

InChI=1S/C25H28F2N4O3/c1-3-5-6-9-15-31-24(33)18-12-8-7-11-17(18)22(29-31)25(34)30(4-2)16-21(32)28-23-19(26)13-10-14-20(23)27/h7-8,10-14H,3-6,9,15-16H2,1-2H3,(H,28,32)