N-[3-(benzimidazol-1-yl)propyl]-3-ethyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[3-(benzimidazol-1-yl)propyl]-3-ethyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[3-(benzimidazol-1-yl)propyl]-3-ethyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[3-(1-benzimidazolyl)propyl]-3-ethyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[3-(benzimidazol-1-yl)propyl]-3-ethyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[3-(benzimidazol-1-yl)propyl]-3-ethyl-4-keto-phthalazine-1-carboxamide Formula: C21H21N5O2 MolecularWeight: 375.42374

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCCCN3C=NC4=CC=CC=C43

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCCCN3C=NC4=CC=CC=C43

InChI

InChI=1S/C21H21N5O2/c1-2-26-21(28)16-9-4-3-8-15(16)19(24-26)20(27)22-12-7-13-25-14-23-17-10-5-6-11-18(17)25/h3-6,8-11,14H,2,7,12-13H2,1H3,(H,22,27)