N-(1H-benzimidazol-2-yl)-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide

Systemtic Name: N-(1H-benzimidazol-2-yl)-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide Openeye Name: N-(1H-benzimidazol-2-yl)-4-oxo-3-pentyl-phthalazine-1-carboxamide CAS Name: N-(1H-benzimidazol-2-yl)-4-oxo-3-pentyl-1-phthalazinecarboxamide IUPAC Name: N-(1H-benzimidazol-2-yl)-4-oxo-3-pentylphthalazine-1-carboxamide Traditional Name: 3-amyl-N-(1H-benzimidazol-2-yl)-4-keto-phthalazine-1-carboxamide Formula: C21H21N5O2 MolecularWeight: 375.42374

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC4=CC=CC=C4N3

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C21H21N5O2/c1-2-3-8-13-26-20(28)15-10-5-4-9-14(15)18(25-26)19(27)24-21-22-16-11-6-7-12-17(16)23-21/h4-7,9-12H,2-3,8,13H2,1H3,(H2,22,23,24,27)