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

Systemtic Name: ethyl 3-[3-[3,5-dimethyl-1-(6-piperidin-1-ylpyridazin-3-yl)pyrazol-4-yl]propanoylamino]benzoate Openeye Name: ethyl 3-[3-[3,5-dimethyl-1-[6-(1-piperidyl)pyridazin-3-yl]pyrazol-4-yl]propanoylamino]benzoate CAS Name: 3-[[3-[3,5-dimethyl-1-[6-(1-piperidinyl)-3-pyridazinyl]-4-pyrazolyl]-1-oxopropyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[3-[3,5-dimethyl-1-(6-piperidin-1-ylpyridazin-3-yl)pyrazol-4-yl]propanoylamino]benzoate Traditional Name: 3-[3-[3,5-dimethyl-1-(6-piperidinopyridazin-3-yl)pyrazol-4-yl]propanoylamino]benzoic acid ethyl ester Formula: C26H32N6O3 MolecularWeight: 476.57068

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)CCC2=C(N(N=C2C)C3=NN=C(C=C3)N4CCCCC4)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)CCC2=C(N(N=C2C)C3=NN=C(C=C3)N4CCCCC4)C

InChI

InChI=1S/C26H32N6O3/c1-4-35-26(34)20-9-8-10-21(17-20)27-25(33)14-11-22-18(2)30-32(19(22)3)24-13-12-23(28-29-24)31-15-6-5-7-16-31/h8-10,12-13,17H,4-7,11,14-16H2,1-3H3,(H,27,33)