ethyl 4-[2-cyano-4-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-cyano-4-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-cyano-4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]piperazine-1-carboxylate CAS Name: 4-[2-cyano-4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-cyano-4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]piperazine-1-carboxylate Traditional Name: 4-[2-cyano-4-(6-keto-4-methyl-4,5-dihydro-1H-pyridazin-3-yl)phenyl]piperazine-1-carboxylic acid ethyl ester Formula: C19H23N5O3 MolecularWeight: 369.41762

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C3=NNC(=O)CC3C)C#N

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C3=NNC(=O)CC3C)C#N

InChI

InChI=1S/C19H23N5O3/c1-3-27-19(26)24-8-6-23(7-9-24)16-5-4-14(11-15(16)12-20)18-13(2)10-17(25)21-22-18/h4-5,11,13H,3,6-10H2,1-2H3,(H,21,25)