1-[5-azanyl-1-(4-fluorophenyl)-3-phenyl-pyrazol-4-yl]-3-[3-(dimethylamino)propyl]urea

Systemtic Name: 1-[5-azanyl-1-(4-fluorophenyl)-3-phenyl-pyrazol-4-yl]-3-[3-(dimethylamino)propyl]urea Openeye Name: 1-[5-amino-1-(4-fluorophenyl)-3-phenyl-pyrazol-4-yl]-3-[3-(dimethylamino)propyl]urea CAS Name: 1-[5-amino-1-(4-fluorophenyl)-3-phenyl-4-pyrazolyl]-3-[3-(dimethylamino)propyl]urea IUPAC Name: 1-[5-amino-1-(4-fluorophenyl)-3-phenylpyrazol-4-yl]-3-[3-(dimethylamino)propyl]urea Traditional Name: 1-[5-amino-1-(4-fluorophenyl)-3-phenyl-pyrazol-4-yl]-3-[3-(dimethylamino)propyl]urea Formula: C21H25FN6O MolecularWeight: 396.461203

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCNC(=O)NC1=C(N(N=C1C2=CC=CC=C2)C3=CC=C(C=C3)F)N

Isomeric SMILES

CN(C)CCCNC(=O)NC1=C(N(N=C1C2=CC=CC=C2)C3=CC=C(C=C3)F)N

InChI

InChI=1S/C21H25FN6O/c1-27(2)14-6-13-24-21(29)25-19-18(15-7-4-3-5-8-15)26-28(20(19)23)17-11-9-16(22)10-12-17/h3-5,7-12H,6,13-14,23H2,1-2H3,(H2,24,25,29)