2-(cyclopropylmethyl)-6-(3-fluoranyl-4-methoxy-phenyl)-4-(piperazin-1-ylmethyl)pyridazin-3-one dihydrochloride

Systemtic Name: 2-(cyclopropylmethyl)-6-(3-fluoranyl-4-methoxy-phenyl)-4-(piperazin-1-ylmethyl)pyridazin-3-one dihydrochloride Openeye Name: 2-(cyclopropylmethyl)-6-(3-fluoro-4-methoxy-phenyl)-4-(piperazin-1-ylmethyl)pyridazin-3-one dihydrochloride CAS Name: 2-(cyclopropylmethyl)-6-(3-fluoro-4-methoxyphenyl)-4-(1-piperazinylmethyl)-3-pyridazinone dihydrochloride IUPAC Name: 2-(cyclopropylmethyl)-6-(3-fluoro-4-methoxyphenyl)-4-(piperazin-1-ylmethyl)pyridazin-3-one dihydrochloride Traditional Name: 2-(cyclopropylmethyl)-6-(3-fluoro-4-methoxy-phenyl)-4-(piperazinomethyl)pyridazin-3-one dihydrochloride Formula: C20H27Cl2FN4O2 MolecularWeight: 445.358383

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C(=O)C(=C2)CN3CCNCC3)CC4CC4)F.Cl.Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C(=O)C(=C2)CN3CCNCC3)CC4CC4)F.Cl.Cl

InChI

InChI=1S/C20H25FN4O2.2ClH/c1-27-19-5-4-15(10-17(19)21)18-11-16(13-24-8-6-22-7-9-24)20(26)25(23-18)12-14-2-3-14;;/h4-5,10-11,14,22H,2-3,6-9,12-13H2,1H3;2*1H