ethyl 4-[(4-butylcyclohexyl)carbonylamino]-1-(2-methylphenyl)-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: ethyl 4-[(4-butylcyclohexyl)carbonylamino]-1-(2-methylphenyl)-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 4-[(4-butylcyclohexanecarbonyl)amino]-1-(o-tolyl)-6-oxo-pyridazine-3-carboxylate CAS Name: 4-[[(4-butylcyclohexyl)-oxomethyl]amino]-1-(2-methylphenyl)-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4-butylcyclohexanecarbonyl)amino]-1-(2-methylphenyl)-6-oxopyridazine-3-carboxylate Traditional Name: 4-[(4-butylcyclohexanecarbonyl)amino]-6-keto-1-(o-tolyl)pyridazine-3-carboxylic acid ethyl ester Formula: C25H33N3O4 MolecularWeight: 439.54722

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C(=O)NC2=CC(=O)N(N=C2C(=O)OCC)C3=CC=CC=C3C

Isomeric SMILES

CCCCC1CCC(CC1)C(=O)NC2=CC(=O)N(N=C2C(=O)OCC)C3=CC=CC=C3C

InChI

InChI=1S/C25H33N3O4/c1-4-6-10-18-12-14-19(15-13-18)24(30)26-20-16-22(29)28(21-11-8-7-9-17(21)3)27-23(20)25(31)32-5-2/h7-9,11,16,18-19H,4-6,10,12-15H2,1-3H3,(H,26,30)