4-[[6-(4-carbamimidoylphenyl)-3-oxidanylidene-2-phenyl-pyridazin-4-yl]carbonylamino]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[[6-(4-carbamimidoylphenyl)-3-oxidanylidene-2-phenyl-pyridazin-4-yl]carbonylamino]cyclohexane-1-carboxylic acid Openeye Name: 4-[[6-(4-carbamimidoylphenyl)-3-oxo-2-phenyl-pyridazine-4-carbonyl]amino]cyclohexanecarboxylic acid CAS Name: 4-[[[6-(4-carbamimidoylphenyl)-3-oxo-2-phenyl-4-pyridazinyl]-oxomethyl]amino]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[[6-(4-carbamimidoylphenyl)-3-oxo-2-phenylpyridazine-4-carbonyl]amino]cyclohexane-1-carboxylic acid Traditional Name: 4-[[6-(4-amidinophenyl)-3-keto-2-phenyl-pyridazine-4-carbonyl]amino]cyclohexanecarboxylic acid Formula: C25H25N5O4 MolecularWeight: 459.4971

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C(=O)O)NC(=O)C2=CC(=NN(C2=O)C3=CC=CC=C3)C4=CC=C(C=C4)C(=N)N

Isomeric SMILES

C1CC(CCC1C(=O)O)NC(=O)C2=CC(=NN(C2=O)C3=CC=CC=C3)C4=CC=C(C=C4)C(=N)N

InChI

InChI=1S/C25H25N5O4/c26-22(27)16-8-6-15(7-9-16)21-14-20(24(32)30(29-21)19-4-2-1-3-5-19)23(31)28-18-12-10-17(11-13-18)25(33)34/h1-9,14,17-18H,10-13H2,(H3,26,27)(H,28,31)(H,33,34)