N-(3-imidazol-1-ylpropyl)-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide

Systemtic Name: N-(3-imidazol-1-ylpropyl)-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide Openeye Name: N-(3-imidazol-1-ylpropyl)-4-oxo-3-pentyl-phthalazine-1-carboxamide CAS Name: N-[3-(1-imidazolyl)propyl]-4-oxo-3-pentyl-1-phthalazinecarboxamide IUPAC Name: N-(3-imidazol-1-ylpropyl)-4-oxo-3-pentylphthalazine-1-carboxamide Traditional Name: 3-amyl-N-(3-imidazol-1-ylpropyl)-4-keto-phthalazine-1-carboxamide Formula: C20H25N5O2 MolecularWeight: 367.4448

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCCCN3C=CN=C3

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCCCN3C=CN=C3

InChI

InChI=1S/C20H25N5O2/c1-2-3-6-13-25-20(27)17-9-5-4-8-16(17)18(23-25)19(26)22-10-7-12-24-14-11-21-15-24/h4-5,8-9,11,14-15H,2-3,6-7,10,12-13H2,1H3,(H,22,26)