1-(3-chloranyl-4-fluoranyl-phenyl)-3-[5-methyl-1-(phenylmethyl)pyrazol-3-yl]urea

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-3-[5-methyl-1-(phenylmethyl)pyrazol-3-yl]urea Openeye Name: 1-(1-benzyl-5-methyl-pyrazol-3-yl)-3-(3-chloro-4-fluoro-phenyl)urea CAS Name: 1-(3-chloro-4-fluorophenyl)-3-[5-methyl-1-(phenylmethyl)-3-pyrazolyl]urea IUPAC Name: 1-(1-benzyl-5-methylpyrazol-3-yl)-3-(3-chloro-4-fluorophenyl)urea Traditional Name: 1-(1-benzyl-5-methyl-pyrazol-3-yl)-3-(3-chloro-4-fluoro-phenyl)urea Formula: C18H16ClFN4O MolecularWeight: 358.797243

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16ClFN4O/c1-12-9-17(23-24(12)11-13-5-3-2-4-6-13)22-18(25)21-14-7-8-16(20)15(19)10-14/h2-10H,11H2,1H3,(H2,21,22,23,25)