5-ethyl-3-(4-imidazol-1-ylphenyl)-6-oxidanyl-imidazo[5,1-a]phthalazin-1-one

Systemtic Name: 5-ethyl-3-(4-imidazol-1-ylphenyl)-6-oxidanyl-imidazo[5,1-a]phthalazin-1-one Openeye Name: 5-ethyl-6-hydroxy-3-(4-imidazol-1-ylphenyl)imidazo[5,1-a]phthalazin-1-one CAS Name: 5-ethyl-6-hydroxy-3-[4-(1-imidazolyl)phenyl]-1-imidazo[5,1-a]phthalazinone IUPAC Name: 5-ethyl-6-hydroxy-3-(4-imidazol-1-ylphenyl)imidazo[5,1-a]phthalazin-1-one Traditional Name: 5-ethyl-6-hydroxy-3-(4-imidazol-1-ylphenyl)imidazo[5,1-a]phthalazin-1-one Formula: C21H17N5O2 MolecularWeight: 371.39198

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C2C=CC=CC2=C3N1C(=NC3=O)C4=CC=C(C=C4)N5C=CN=C5)O

Isomeric SMILES

CCN1C(=C2C=CC=CC2=C3N1C(=NC3=O)C4=CC=C(C=C4)N5C=CN=C5)O

InChI

InChI=1S/C21H17N5O2/c1-2-25-21(28)17-6-4-3-5-16(17)18-20(27)23-19(26(18)25)14-7-9-15(10-8-14)24-12-11-22-13-24/h3-13,28H,2H2,1H3