1-[(4-fluoranyl-3-methyl-phenyl)methyl]-3-[2-(4-pyrazol-1-ylphenyl)ethyl]urea

Systemtic Name: 1-[(4-fluoranyl-3-methyl-phenyl)methyl]-3-[2-(4-pyrazol-1-ylphenyl)ethyl]urea Openeye Name: 1-[(4-fluoro-3-methyl-phenyl)methyl]-3-[2-(4-pyrazol-1-ylphenyl)ethyl]urea CAS Name: 1-[(4-fluoro-3-methylphenyl)methyl]-3-[2-[4-(1-pyrazolyl)phenyl]ethyl]urea IUPAC Name: 1-[(4-fluoro-3-methylphenyl)methyl]-3-[2-(4-pyrazol-1-ylphenyl)ethyl]urea Traditional Name: 1-(4-fluoro-3-methyl-benzyl)-3-[2-(4-pyrazol-1-ylphenyl)ethyl]urea Formula: C20H21FN4O MolecularWeight: 352.405343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CNC(=O)NCCC2=CC=C(C=C2)N3C=CC=N3)F

Isomeric SMILES

CC1=C(C=CC(=C1)CNC(=O)NCCC2=CC=C(C=C2)N3C=CC=N3)F

InChI

InChI=1S/C20H21FN4O/c1-15-13-17(5-8-19(15)21)14-23-20(26)22-11-9-16-3-6-18(7-4-16)25-12-2-10-24-25/h2-8,10,12-13H,9,11,14H2,1H3,(H2,22,23,26)