(3,4-diethoxyphenyl)-[4-(6-pyrazol-1-ylpyridazin-3-yl)piperazin-1-yl]methanone

Systemtic Name: (3,4-diethoxyphenyl)-[4-(6-pyrazol-1-ylpyridazin-3-yl)piperazin-1-yl]methanone Openeye Name: (3,4-diethoxyphenyl)-[4-(6-pyrazol-1-ylpyridazin-3-yl)piperazin-1-yl]methanone CAS Name: (3,4-diethoxyphenyl)-[4-[6-(1-pyrazolyl)-3-pyridazinyl]-1-piperazinyl]methanone IUPAC Name: (3,4-diethoxyphenyl)-[4-(6-pyrazol-1-ylpyridazin-3-yl)piperazin-1-yl]methanone Traditional Name: (3,4-diethoxyphenyl)-[4-(6-pyrazol-1-ylpyridazin-3-yl)piperazino]methanone Formula: C22H26N6O3 MolecularWeight: 422.48024

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=NN=C(C=C3)N4C=CC=N4)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=NN=C(C=C3)N4C=CC=N4)OCC

InChI

InChI=1S/C22H26N6O3/c1-3-30-18-7-6-17(16-19(18)31-4-2)22(29)27-14-12-26(13-15-27)20-8-9-21(25-24-20)28-11-5-10-23-28/h5-11,16H,3-4,12-15H2,1-2H3