N-(3-fluoranyl-4-methyl-phenyl)-4-(6-phenylpyridazin-3-yl)piperazine-1-carboxamide

Systemtic Name: N-(3-fluoranyl-4-methyl-phenyl)-4-(6-phenylpyridazin-3-yl)piperazine-1-carboxamide Openeye Name: N-(3-fluoro-4-methyl-phenyl)-4-(6-phenylpyridazin-3-yl)piperazine-1-carboxamide CAS Name: N-(3-fluoro-4-methylphenyl)-4-(6-phenyl-3-pyridazinyl)-1-piperazinecarboxamide IUPAC Name: N-(3-fluoro-4-methylphenyl)-4-(6-phenylpyridazin-3-yl)piperazine-1-carboxamide Traditional Name: N-(3-fluoro-4-methyl-phenyl)-4-(6-phenylpyridazin-3-yl)piperazine-1-carboxamide Formula: C22H22FN5O MolecularWeight: 391.441383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)N2CCN(CC2)C3=NN=C(C=C3)C4=CC=CC=C4)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)N2CCN(CC2)C3=NN=C(C=C3)C4=CC=CC=C4)F

InChI

InChI=1S/C22H22FN5O/c1-16-7-8-18(15-19(16)23)24-22(29)28-13-11-27(12-14-28)21-10-9-20(25-26-21)17-5-3-2-4-6-17/h2-10,15H,11-14H2,1H3,(H,24,29)