N-[(1-ethylbenzimidazol-2-yl)methyl]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide

Systemtic Name: N-[(1-ethylbenzimidazol-2-yl)methyl]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-[(1-ethylbenzimidazol-2-yl)methyl]-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-[(1-ethyl-2-benzimidazolyl)methyl]-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-[(1-ethylbenzimidazol-2-yl)methyl]-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: N-[(1-ethylbenzimidazol-2-yl)methyl]-4-keto-3-propyl-phthalazine-1-carboxamide Formula: C22H23N5O2 MolecularWeight: 389.45032

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=NC4=CC=CC=C4N3CC

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=NC4=CC=CC=C4N3CC

InChI

InChI=1S/C22H23N5O2/c1-3-13-27-22(29)16-10-6-5-9-15(16)20(25-27)21(28)23-14-19-24-17-11-7-8-12-18(17)26(19)4-2/h5-12H,3-4,13-14H2,1-2H3,(H,23,28)