1-[5-tert-butyl-2-(3,4-dimethylphenyl)pyrazol-3-yl]-3-(4-fluorophenyl)urea

Systemtic Name: 1-[5-tert-butyl-2-(3,4-dimethylphenyl)pyrazol-3-yl]-3-(4-fluorophenyl)urea Openeye Name: 1-[5-tert-butyl-2-(3,4-dimethylphenyl)pyrazol-3-yl]-3-(4-fluorophenyl)urea CAS Name: 1-[5-tert-butyl-2-(3,4-dimethylphenyl)-3-pyrazolyl]-3-(4-fluorophenyl)urea IUPAC Name: 1-[5-tert-butyl-2-(3,4-dimethylphenyl)pyrazol-3-yl]-3-(4-fluorophenyl)urea Traditional Name: 1-[5-tert-butyl-2-(3,4-dimethylphenyl)pyrazol-3-yl]-3-(4-fluorophenyl)urea Formula: C22H25FN4O MolecularWeight: 380.458503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)NC3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)NC3=CC=C(C=C3)F)C

InChI

InChI=1S/C22H25FN4O/c1-14-6-11-18(12-15(14)2)27-20(13-19(26-27)22(3,4)5)25-21(28)24-17-9-7-16(23)8-10-17/h6-13H,1-5H3,(H2,24,25,28)