ethyl 2-[[4-[1-(4-methylphenyl)-6-oxidanylidene-pyridazin-3-yl]piperazin-1-yl]carbonylamino]ethanoate

Systemtic Name: ethyl 2-[[4-[1-(4-methylphenyl)-6-oxidanylidene-pyridazin-3-yl]piperazin-1-yl]carbonylamino]ethanoate Openeye Name: ethyl 2-[[4-[6-oxo-1-(p-tolyl)pyridazin-3-yl]piperazine-1-carbonyl]amino]acetate CAS Name: 2-[[[4-[1-(4-methylphenyl)-6-oxo-3-pyridazinyl]-1-piperazinyl]-oxomethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[4-[1-(4-methylphenyl)-6-oxopyridazin-3-yl]piperazine-1-carbonyl]amino]acetate Traditional Name: 2-[[4-[6-keto-1-(p-tolyl)pyridazin-3-yl]piperazine-1-carbonyl]amino]acetic acid ethyl ester Formula: C20H25N5O4 MolecularWeight: 399.4436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)N1CCN(CC1)C2=NN(C(=O)C=C2)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)CNC(=O)N1CCN(CC1)C2=NN(C(=O)C=C2)C3=CC=C(C=C3)C

InChI

InChI=1S/C20H25N5O4/c1-3-29-19(27)14-21-20(28)24-12-10-23(11-13-24)17-8-9-18(26)25(22-17)16-6-4-15(2)5-7-16/h4-9H,3,10-14H2,1-2H3,(H,21,28)