N-[1-(4-imidazol-1-ylphenyl)ethyl]-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide

Systemtic Name: N-[1-(4-imidazol-1-ylphenyl)ethyl]-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide Openeye Name: N-[1-(4-imidazol-1-ylphenyl)ethyl]-4-oxo-3-pentyl-phthalazine-1-carboxamide CAS Name: N-[1-[4-(1-imidazolyl)phenyl]ethyl]-4-oxo-3-pentyl-1-phthalazinecarboxamide IUPAC Name: N-[1-(4-imidazol-1-ylphenyl)ethyl]-4-oxo-3-pentylphthalazine-1-carboxamide Traditional Name: 3-amyl-N-[1-(4-imidazol-1-ylphenyl)ethyl]-4-keto-phthalazine-1-carboxamide Formula: C25H27N5O2 MolecularWeight: 429.51418

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC(C)C3=CC=C(C=C3)N4C=CN=C4

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC(C)C3=CC=C(C=C3)N4C=CN=C4

InChI

InChI=1S/C25H27N5O2/c1-3-4-7-15-30-25(32)22-9-6-5-8-21(22)23(28-30)24(31)27-18(2)19-10-12-20(13-11-19)29-16-14-26-17-29/h5-6,8-14,16-18H,3-4,7,15H2,1-2H3,(H,27,31)