ethyl 3-[3-[3,5-dimethyl-1-(6-pyrrolidin-1-ylpyridazin-3-yl)pyrazol-4-yl]propanoylamino]benzoate

Systemtic Name: ethyl 3-[3-[3,5-dimethyl-1-(6-pyrrolidin-1-ylpyridazin-3-yl)pyrazol-4-yl]propanoylamino]benzoate Openeye Name: ethyl 3-[3-[3,5-dimethyl-1-(6-pyrrolidin-1-ylpyridazin-3-yl)pyrazol-4-yl]propanoylamino]benzoate CAS Name: 3-[[3-[3,5-dimethyl-1-[6-(1-pyrrolidinyl)-3-pyridazinyl]-4-pyrazolyl]-1-oxopropyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[3-[3,5-dimethyl-1-(6-pyrrolidin-1-ylpyridazin-3-yl)pyrazol-4-yl]propanoylamino]benzoate Traditional Name: 3-[3-[3,5-dimethyl-1-(6-pyrrolidinopyridazin-3-yl)pyrazol-4-yl]propanoylamino]benzoic acid ethyl ester Formula: C25H30N6O3 MolecularWeight: 462.5441

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)CCC2=C(N(N=C2C)C3=NN=C(C=C3)N4CCCC4)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)CCC2=C(N(N=C2C)C3=NN=C(C=C3)N4CCCC4)C

InChI

InChI=1S/C25H30N6O3/c1-4-34-25(33)19-8-7-9-20(16-19)26-24(32)13-10-21-17(2)29-31(18(21)3)23-12-11-22(27-28-23)30-14-5-6-15-30/h7-9,11-12,16H,4-6,10,13-15H2,1-3H3,(H,26,32)