N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-3-methoxy-1-methyl-pyrazole-4-carboxamide

Systemtic Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-3-methoxy-1-methyl-pyrazole-4-carboxamide Openeye Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-3-methoxy-1-methyl-pyrazole-4-carboxamide CAS Name: N-[3-[6-(1-azepanyl)-3-pyridazinyl]phenyl]-3-methoxy-1-methyl-4-pyrazolecarboxamide IUPAC Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-3-methoxy-1-methylpyrazole-4-carboxamide Traditional Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-3-methoxy-1-methyl-pyrazole-4-carboxamide Formula: C22H26N6O2 MolecularWeight: 406.48084

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)OC)C(=O)NC2=CC=CC(=C2)C3=NN=C(C=C3)N4CCCCCC4

Isomeric SMILES

CN1C=C(C(=N1)OC)C(=O)NC2=CC=CC(=C2)C3=NN=C(C=C3)N4CCCCCC4

InChI

InChI=1S/C22H26N6O2/c1-27-15-18(22(26-27)30-2)21(29)23-17-9-7-8-16(14-17)19-10-11-20(25-24-19)28-12-5-3-4-6-13-28/h7-11,14-15H,3-6,12-13H2,1-2H3,(H,23,29)