N-(2-cyclopropylethyl)-6-[4-(5-fluoranyl-2-methoxy-phenyl)carbonylpiperazin-1-yl]pyridazine-3-carboxamide

Systemtic Name: N-(2-cyclopropylethyl)-6-[4-(5-fluoranyl-2-methoxy-phenyl)carbonylpiperazin-1-yl]pyridazine-3-carboxamide Openeye Name: N-(2-cyclopropylethyl)-6-[4-(5-fluoro-2-methoxy-benzoyl)piperazin-1-yl]pyridazine-3-carboxamide CAS Name: N-(2-cyclopropylethyl)-6-[4-[(5-fluoro-2-methoxyphenyl)-oxomethyl]-1-piperazinyl]-3-pyridazinecarboxamide IUPAC Name: N-(2-cyclopropylethyl)-6-[4-(5-fluoro-2-methoxybenzoyl)piperazin-1-yl]pyridazine-3-carboxamide Traditional Name: N-(2-cyclopropylethyl)-6-[4-(5-fluoro-2-methoxy-benzoyl)piperazino]pyridazine-3-carboxamide Formula: C22H26FN5O3 MolecularWeight: 427.471943

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)F)C(=O)N2CCN(CC2)C3=NN=C(C=C3)C(=O)NCCC4CC4

Isomeric SMILES

COC1=C(C=C(C=C1)F)C(=O)N2CCN(CC2)C3=NN=C(C=C3)C(=O)NCCC4CC4

InChI

InChI=1S/C22H26FN5O3/c1-31-19-6-4-16(23)14-17(19)22(30)28-12-10-27(11-13-28)20-7-5-18(25-26-20)21(29)24-9-8-15-2-3-15/h4-7,14-15H,2-3,8-13H2,1H3,(H,24,29)