5-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]amino]-3-(3-imidazol-1-ylpropyl)-4-phenyl-4H-imidazol-2-one

Systemtic Name: 5-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]amino]-3-(3-imidazol-1-ylpropyl)-4-phenyl-4H-imidazol-2-one Openeye Name: 5-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]amino]-3-(3-imidazol-1-ylpropyl)-4-phenyl-4H-imidazol-2-one CAS Name: 5-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]amino]-3-[3-(1-imidazolyl)propyl]-4-phenyl-4H-imidazol-2-one IUPAC Name: 5-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]amino]-3-(3-imidazol-1-ylpropyl)-4-phenyl-4H-imidazol-2-one Traditional Name: 4-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]amino]-1-(3-imidazol-1-ylpropyl)-5-phenyl-3-imidazolin-2-one Formula: C26H28N6O2 MolecularWeight: 456.53952

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)CNC3=NC(=O)N(C3C4=CC=CC=C4)CCCN5C=CN=C5

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)CNC3=NC(=O)N(C3C4=CC=CC=C4)CCCN5C=CN=C5

InChI

InChI=1S/C26H28N6O2/c33-23(31-15-11-20-7-4-5-10-22(20)18-31)17-28-25-24(21-8-2-1-3-9-21)32(26(34)29-25)14-6-13-30-16-12-27-19-30/h1-5,7-10,12,16,19,24H,6,11,13-15,17-18H2,(H,28,29,34)