3-[5-azanyl-1-[2,5-bis(fluoranyl)phenyl]-3-tert-butyl-pyrazol-4-yl]-1-ethyl-1-methyl-urea

Systemtic Name: 3-[5-azanyl-1-[2,5-bis(fluoranyl)phenyl]-3-tert-butyl-pyrazol-4-yl]-1-ethyl-1-methyl-urea Openeye Name: 3-[5-amino-3-tert-butyl-1-(2,5-difluorophenyl)pyrazol-4-yl]-1-ethyl-1-methyl-urea CAS Name: 3-[5-amino-3-tert-butyl-1-(2,5-difluorophenyl)-4-pyrazolyl]-1-ethyl-1-methylurea IUPAC Name: 3-[5-amino-3-tert-butyl-1-(2,5-difluorophenyl)pyrazol-4-yl]-1-ethyl-1-methylurea Traditional Name: 3-[5-amino-3-tert-butyl-1-(2,5-difluorophenyl)pyrazol-4-yl]-1-ethyl-1-methyl-urea Formula: C17H23F2N5O MolecularWeight: 351.394226

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C)C(=O)NC1=C(N(N=C1C(C)(C)C)C2=C(C=CC(=C2)F)F)N

Isomeric SMILES

CCN(C)C(=O)NC1=C(N(N=C1C(C)(C)C)C2=C(C=CC(=C2)F)F)N

InChI

InChI=1S/C17H23F2N5O/c1-6-23(5)16(25)21-13-14(17(2,3)4)22-24(15(13)20)12-9-10(18)7-8-11(12)19/h7-9H,6,20H2,1-5H3,(H,21,25)