1-(3-chloranyl-4-fluoranyl-phenyl)-3-[4-(cyclohexen-1-yl)-2,5-dimethyl-pyrazol-3-yl]urea

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-3-[4-(cyclohexen-1-yl)-2,5-dimethyl-pyrazol-3-yl]urea Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-3-[4-(cyclohexen-1-yl)-2,5-dimethyl-pyrazol-3-yl]urea CAS Name: 1-(3-chloro-4-fluorophenyl)-3-[4-(1-cyclohexenyl)-2,5-dimethyl-3-pyrazolyl]urea IUPAC Name: 1-(3-chloro-4-fluorophenyl)-3-[4-(cyclohexen-1-yl)-2,5-dimethylpyrazol-3-yl]urea Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-3-[4-(cyclohexen-1-yl)-2,5-dimethyl-pyrazol-3-yl]urea Formula: C18H20ClFN4O MolecularWeight: 362.829003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C2=CCCCC2)NC(=O)NC3=CC(=C(C=C3)F)Cl)C

Isomeric SMILES

CC1=NN(C(=C1C2=CCCCC2)NC(=O)NC3=CC(=C(C=C3)F)Cl)C

InChI

InChI=1S/C18H20ClFN4O/c1-11-16(12-6-4-3-5-7-12)17(24(2)23-11)22-18(25)21-13-8-9-15(20)14(19)10-13/h6,8-10H,3-5,7H2,1-2H3,(H2,21,22,25)