N-butyl-2-(3-imidazol-1-ylpropyl)-3-oxidanylidene-1H-benzo[de]isoquinoline-1-carboxamide

Systemtic Name: N-butyl-2-(3-imidazol-1-ylpropyl)-3-oxidanylidene-1H-benzo[de]isoquinoline-1-carboxamide Openeye Name: N-butyl-2-(3-imidazol-1-ylpropyl)-3-oxo-1H-benzo[de]isoquinoline-1-carboxamide CAS Name: N-butyl-2-[3-(1-imidazolyl)propyl]-3-oxo-1H-benzo[de]isoquinoline-1-carboxamide IUPAC Name: N-butyl-2-(3-imidazol-1-ylpropyl)-3-oxo-1H-benzo[de]isoquinoline-1-carboxamide Traditional Name: N-butyl-2-(3-imidazol-1-ylpropyl)-3-keto-1H-benzo[de]isoquinoline-1-carboxamide Formula: C23H26N4O2 MolecularWeight: 390.47814

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1C2=CC=CC3=C2C(=CC=C3)C(=O)N1CCCN4C=CN=C4

Isomeric SMILES

CCCCNC(=O)C1C2=CC=CC3=C2C(=CC=C3)C(=O)N1CCCN4C=CN=C4

InChI

InChI=1S/C23H26N4O2/c1-2-3-11-25-22(28)21-18-9-4-7-17-8-5-10-19(20(17)18)23(29)27(21)14-6-13-26-15-12-24-16-26/h4-5,7-10,12,15-16,21H,2-3,6,11,13-14H2,1H3,(H,25,28)