2-(2-azanyl-2-phenyl-ethyl)-6-[(2-fluorophenyl)methyl]-4-(3-methoxyphenyl)-5-methyl-pyridazin-3-one

Systemtic Name: 2-(2-azanyl-2-phenyl-ethyl)-6-[(2-fluorophenyl)methyl]-4-(3-methoxyphenyl)-5-methyl-pyridazin-3-one Openeye Name: 2-(2-amino-2-phenyl-ethyl)-6-[(2-fluorophenyl)methyl]-4-(3-methoxyphenyl)-5-methyl-pyridazin-3-one CAS Name: 2-(2-amino-2-phenylethyl)-6-[(2-fluorophenyl)methyl]-4-(3-methoxyphenyl)-5-methyl-3-pyridazinone IUPAC Name: 2-(2-amino-2-phenylethyl)-6-[(2-fluorophenyl)methyl]-4-(3-methoxyphenyl)-5-methylpyridazin-3-one Traditional Name: 2-(2-amino-2-phenyl-ethyl)-6-(2-fluorobenzyl)-4-(3-methoxyphenyl)-5-methyl-pyridazin-3-one Formula: C27H26FN3O2 MolecularWeight: 443.512643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N=C1CC2=CC=CC=C2F)CC(C3=CC=CC=C3)N)C4=CC(=CC=C4)OC

Isomeric SMILES

CC1=C(C(=O)N(N=C1CC2=CC=CC=C2F)CC(C3=CC=CC=C3)N)C4=CC(=CC=C4)OC

InChI

InChI=1S/C27H26FN3O2/c1-18-25(16-20-11-6-7-14-23(20)28)30-31(17-24(29)19-9-4-3-5-10-19)27(32)26(18)21-12-8-13-22(15-21)33-2/h3-15,24H,16-17,29H2,1-2H3