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

Systemtic Name: cyclohexylmethyl 4-[[6-(4-carbamimidoylphenyl)-2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-3-oxidanylidene-pyridazin-4-yl]carbonylamino]cyclohexane-1-carboxylate Openeye Name: cyclohexylmethyl 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 cyclohexylmethyl ester IUPAC Name: cyclohexylmethyl 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 cyclohexylmethyl ester Formula: C32H42N6O6 MolecularWeight: 606.71248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C32H42N6O6/c33-29(34)23-8-6-22(7-9-23)27-18-26(31(41)38(36-27)19-28(39)37-14-16-43-17-15-37)30(40)35-25-12-10-24(11-13-25)32(42)44-20-21-4-2-1-3-5-21/h6-9,18,21,24-25H,1-5,10-17,19-20H2,(H3,33,34)(H,35,40)