[2-[[3-cyano-4,5-dimethyl-1-(oxolan-2-ylmethyl)pyrrol-2-yl]amino]-2-oxidanylidene-ethyl] 6-oxidanylidene-1-propyl-pyridazine-3-carboxylate

Systemtic Name: [2-[[3-cyano-4,5-dimethyl-1-(oxolan-2-ylmethyl)pyrrol-2-yl]amino]-2-oxidanylidene-ethyl] 6-oxidanylidene-1-propyl-pyridazine-3-carboxylate Openeye Name: [2-[[3-cyano-4,5-dimethyl-1-(tetrahydrofuran-2-ylmethyl)pyrrol-2-yl]amino]-2-oxo-ethyl] 6-oxo-1-propyl-pyridazine-3-carboxylate CAS Name: 6-oxo-1-propyl-3-pyridazinecarboxylic acid [2-[[3-cyano-4,5-dimethyl-1-(2-oxolanylmethyl)-2-pyrrolyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[3-cyano-4,5-dimethyl-1-(oxolan-2-ylmethyl)pyrrol-2-yl]amino]-2-oxoethyl] 6-oxo-1-propylpyridazine-3-carboxylate Traditional Name: 6-keto-1-propyl-pyridazine-3-carboxylic acid [2-[[3-cyano-4,5-dimethyl-1-(tetrahydrofurfuryl)pyrrol-2-yl]amino]-2-keto-ethyl] ester Formula: C22H27N5O5 MolecularWeight: 441.48028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C=CC(=N1)C(=O)OCC(=O)NC2=C(C(=C(N2CC3CCCO3)C)C)C#N

Isomeric SMILES

CCCN1C(=O)C=CC(=N1)C(=O)OCC(=O)NC2=C(C(=C(N2CC3CCCO3)C)C)C#N

InChI

InChI=1S/C22H27N5O5/c1-4-9-27-20(29)8-7-18(25-27)22(30)32-13-19(28)24-21-17(11-23)14(2)15(3)26(21)12-16-6-5-10-31-16/h7-8,16H,4-6,9-10,12-13H2,1-3H3,(H,24,28)