2-cyclopropyl-6-(3-fluoranyl-4-methoxy-phenyl)-5-methyl-4-[(4-methylpiperazin-1-yl)methyl]pyridazin-3-one

Systemtic Name: 2-cyclopropyl-6-(3-fluoranyl-4-methoxy-phenyl)-5-methyl-4-[(4-methylpiperazin-1-yl)methyl]pyridazin-3-one Openeye Name: 2-cyclopropyl-6-(3-fluoro-4-methoxy-phenyl)-5-methyl-4-[(4-methylpiperazin-1-yl)methyl]pyridazin-3-one CAS Name: 2-cyclopropyl-6-(3-fluoro-4-methoxyphenyl)-5-methyl-4-[(4-methyl-1-piperazinyl)methyl]-3-pyridazinone IUPAC Name: 2-cyclopropyl-6-(3-fluoro-4-methoxyphenyl)-5-methyl-4-[(4-methylpiperazin-1-yl)methyl]pyridazin-3-one Traditional Name: 2-cyclopropyl-6-(3-fluoro-4-methoxy-phenyl)-5-methyl-4-[(4-methylpiperazino)methyl]pyridazin-3-one Formula: C21H27FN4O2 MolecularWeight: 386.463083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N=C1C2=CC(=C(C=C2)OC)F)C3CC3)CN4CCN(CC4)C

Isomeric SMILES

CC1=C(C(=O)N(N=C1C2=CC(=C(C=C2)OC)F)C3CC3)CN4CCN(CC4)C

InChI

InChI=1S/C21H27FN4O2/c1-14-17(13-25-10-8-24(2)9-11-25)21(27)26(16-5-6-16)23-20(14)15-4-7-19(28-3)18(22)12-15/h4,7,12,16H,5-6,8-11,13H2,1-3H3