1-(3-ethanoylphenyl)-3-[1-[(3-fluorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]urea

Systemtic Name: 1-(3-ethanoylphenyl)-3-[1-[(3-fluorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]urea Openeye Name: 1-(3-acetylphenyl)-3-[1-[(3-fluorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]urea CAS Name: 1-(3-acetylphenyl)-3-[1-[(3-fluorophenyl)methyl]-3,5-dimethyl-4-pyrazolyl]urea IUPAC Name: 1-(3-acetylphenyl)-3-[1-[(3-fluorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]urea Traditional Name: 1-(3-acetylphenyl)-3-[1-(3-fluorobenzyl)-3,5-dimethyl-pyrazol-4-yl]urea Formula: C21H21FN4O2 MolecularWeight: 380.415443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC(=CC=C2)F)C)NC(=O)NC3=CC=CC(=C3)C(=O)C

Isomeric SMILES

CC1=C(C(=NN1CC2=CC(=CC=C2)F)C)NC(=O)NC3=CC=CC(=C3)C(=O)C

InChI

InChI=1S/C21H21FN4O2/c1-13-20(14(2)26(25-13)12-16-6-4-8-18(22)10-16)24-21(28)23-19-9-5-7-17(11-19)15(3)27/h4-11H,12H2,1-3H3,(H2,23,24,28)