3-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-1-ethyl-1-[(3-fluorophenyl)methyl]urea

Systemtic Name: 3-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-1-ethyl-1-[(3-fluorophenyl)methyl]urea Openeye Name: 3-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-1-ethyl-1-[(3-fluorophenyl)methyl]urea CAS Name: 3-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-1-ethyl-1-[(3-fluorophenyl)methyl]urea IUPAC Name: 3-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-1-ethyl-1-[(3-fluorophenyl)methyl]urea Traditional Name: 1-ethyl-1-(3-fluorobenzyl)-3-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)urea Formula: C21H23FN4O2 MolecularWeight: 382.431323

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=CC=C1)F)C(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C

Isomeric SMILES

CCN(CC1=CC(=CC=C1)F)C(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C

InChI

InChI=1S/C21H23FN4O2/c1-4-25(14-16-9-8-10-17(22)13-16)21(28)23-19-15(2)24(3)26(20(19)27)18-11-6-5-7-12-18/h5-13H,4,14H2,1-3H3,(H,23,28)