ethyl 4-[[5-(4-phenylpiperazin-1-yl)carbonyl-1H-imidazol-4-yl]carbonylamino]benzoate

Systemtic Name: ethyl 4-[[5-(4-phenylpiperazin-1-yl)carbonyl-1H-imidazol-4-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[5-(4-phenylpiperazine-1-carbonyl)-1H-imidazole-4-carbonyl]amino]benzoate CAS Name: 4-[[oxo-[5-[oxo-(4-phenyl-1-piperazinyl)methyl]-1H-imidazol-4-yl]methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[5-(4-phenylpiperazine-1-carbonyl)-1H-imidazole-4-carbonyl]amino]benzoate Traditional Name: 4-[[5-(4-phenylpiperazine-1-carbonyl)-1H-imidazole-4-carbonyl]amino]benzoic acid ethyl ester Formula: C24H25N5O4 MolecularWeight: 447.4864

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(NC=N2)C(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(NC=N2)C(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C24H25N5O4/c1-2-33-24(32)17-8-10-18(11-9-17)27-22(30)20-21(26-16-25-20)23(31)29-14-12-28(13-15-29)19-6-4-3-5-7-19/h3-11,16H,2,12-15H2,1H3,(H,25,26)(H,27,30)