[1-(6-ethoxypyridazin-3-yl)-5-methyl-pyrazol-4-yl]-[2-(4-methoxyphenyl)azepan-1-yl]methanone

Systemtic Name: [1-(6-ethoxypyridazin-3-yl)-5-methyl-pyrazol-4-yl]-[2-(4-methoxyphenyl)azepan-1-yl]methanone Openeye Name: [1-(6-ethoxypyridazin-3-yl)-5-methyl-pyrazol-4-yl]-[2-(4-methoxyphenyl)azepan-1-yl]methanone CAS Name: [1-(6-ethoxy-3-pyridazinyl)-5-methyl-4-pyrazolyl]-[2-(4-methoxyphenyl)-1-azepanyl]methanone IUPAC Name: [1-(6-ethoxypyridazin-3-yl)-5-methylpyrazol-4-yl]-[2-(4-methoxyphenyl)azepan-1-yl]methanone Traditional Name: [1-(6-ethoxypyridazin-3-yl)-5-methyl-pyrazol-4-yl]-[2-(4-methoxyphenyl)azepan-1-yl]methanone Formula: C24H29N5O3 MolecularWeight: 435.51876

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NN=C(C=C1)N2C(=C(C=N2)C(=O)N3CCCCCC3C4=CC=C(C=C4)OC)C

Isomeric SMILES

CCOC1=NN=C(C=C1)N2C(=C(C=N2)C(=O)N3CCCCCC3C4=CC=C(C=C4)OC)C

InChI

InChI=1S/C24H29N5O3/c1-4-32-23-14-13-22(26-27-23)29-17(2)20(16-25-29)24(30)28-15-7-5-6-8-21(28)18-9-11-19(31-3)12-10-18/h9-14,16,21H,4-8,15H2,1-3H3