1-(3-chloranyl-4-fluoranyl-phenyl)-3-[3-(4,4-dimethyl-5-oxidanylidene-1H-pyrazol-3-yl)phenyl]urea

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-3-[3-(4,4-dimethyl-5-oxidanylidene-1H-pyrazol-3-yl)phenyl]urea Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-3-[3-(4,4-dimethyl-5-oxo-1H-pyrazol-3-yl)phenyl]urea CAS Name: 1-(3-chloro-4-fluorophenyl)-3-[3-(4,4-dimethyl-5-oxo-1H-pyrazol-3-yl)phenyl]urea IUPAC Name: 1-(3-chloro-4-fluorophenyl)-3-[3-(4,4-dimethyl-5-oxo-1H-pyrazol-3-yl)phenyl]urea Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-3-[3-(5-keto-4,4-dimethyl-2-pyrazolin-3-yl)phenyl]urea Formula: C18H16ClFN4O2 MolecularWeight: 374.796643

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=NNC1=O)C2=CC(=CC=C2)NC(=O)NC3=CC(=C(C=C3)F)Cl)C

Isomeric SMILES

CC1(C(=NNC1=O)C2=CC(=CC=C2)NC(=O)NC3=CC(=C(C=C3)F)Cl)C

InChI

InChI=1S/C18H16ClFN4O2/c1-18(2)15(23-24-16(18)25)10-4-3-5-11(8-10)21-17(26)22-12-6-7-14(20)13(19)9-12/h3-9H,1-2H3,(H,24,25)(H2,21,22,26)