N-[2-(azepan-1-yl)propyl]-1-(6-ethoxypyridazin-3-yl)-5-methyl-pyrazole-4-carboxamide

Systemtic Name: N-[2-(azepan-1-yl)propyl]-1-(6-ethoxypyridazin-3-yl)-5-methyl-pyrazole-4-carboxamide Openeye Name: N-[2-(azepan-1-yl)propyl]-1-(6-ethoxypyridazin-3-yl)-5-methyl-pyrazole-4-carboxamide CAS Name: N-[2-(1-azepanyl)propyl]-1-(6-ethoxy-3-pyridazinyl)-5-methyl-4-pyrazolecarboxamide IUPAC Name: N-[2-(azepan-1-yl)propyl]-1-(6-ethoxypyridazin-3-yl)-5-methylpyrazole-4-carboxamide Traditional Name: N-[2-(azepan-1-yl)propyl]-1-(6-ethoxypyridazin-3-yl)-5-methyl-pyrazole-4-carboxamide Formula: C20H30N6O2 MolecularWeight: 386.4912

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NN=C(C=C1)N2C(=C(C=N2)C(=O)NCC(C)N3CCCCCC3)C

Isomeric SMILES

CCOC1=NN=C(C=C1)N2C(=C(C=N2)C(=O)NCC(C)N3CCCCCC3)C

InChI

InChI=1S/C20H30N6O2/c1-4-28-19-10-9-18(23-24-19)26-16(3)17(14-22-26)20(27)21-13-15(2)25-11-7-5-6-8-12-25/h9-10,14-15H,4-8,11-13H2,1-3H3,(H,21,27)