cyclohexyl 4-[[6-(4-carbamimidoylphenyl)-2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-3-oxidanylidene-pyridazin-4-yl]carbonylamino]cyclohexane-1-carboxylate

Systemtic Name: cyclohexyl 4-[[6-(4-carbamimidoylphenyl)-2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-3-oxidanylidene-pyridazin-4-yl]carbonylamino]cyclohexane-1-carboxylate Openeye Name: cyclohexyl 4-[[6-(4-carbamimidoylphenyl)-2-(2-morpholino-2-oxo-ethyl)-3-oxo-pyridazine-4-carbonyl]amino]cyclohexanecarboxylate CAS Name: 4-[[[6-(4-carbamimidoylphenyl)-2-[2-(4-morpholinyl)-2-oxoethyl]-3-oxo-4-pyridazinyl]-oxomethyl]amino]-1-cyclohexanecarboxylic acid cyclohexyl ester IUPAC Name: cyclohexyl 4-[[6-(4-carbamimidoylphenyl)-2-(2-morpholin-4-yl-2-oxoethyl)-3-oxopyridazine-4-carbonyl]amino]cyclohexane-1-carboxylate Traditional Name: 4-[[6-(4-amidinophenyl)-3-keto-2-(2-keto-2-morpholino-ethyl)pyridazine-4-carbonyl]amino]cyclohexanecarboxylic acid cyclohexyl ester Formula: C31H40N6O6 MolecularWeight: 592.6859

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC(=O)C2CCC(CC2)NC(=O)C3=CC(=NN(C3=O)CC(=O)N4CCOCC4)C5=CC=C(C=C5)C(=N)N

Isomeric SMILES

C1CCC(CC1)OC(=O)C2CCC(CC2)NC(=O)C3=CC(=NN(C3=O)CC(=O)N4CCOCC4)C5=CC=C(C=C5)C(=N)N

InChI

InChI=1S/C31H40N6O6/c32-28(33)21-8-6-20(7-9-21)26-18-25(30(40)37(35-26)19-27(38)36-14-16-42-17-15-36)29(39)34-23-12-10-22(11-13-23)31(41)43-24-4-2-1-3-5-24/h6-9,18,22-24H,1-5,10-17,19H2,(H3,32,33)(H,34,39)