1-[5-azanyl-3-phenyl-1-[4-(trifluoromethyl)phenyl]pyrazol-4-yl]-3-(pyridin-4-ylmethyl)urea

Systemtic Name: 1-[5-azanyl-3-phenyl-1-[4-(trifluoromethyl)phenyl]pyrazol-4-yl]-3-(pyridin-4-ylmethyl)urea Openeye Name: 1-[5-amino-3-phenyl-1-[4-(trifluoromethyl)phenyl]pyrazol-4-yl]-3-(4-pyridylmethyl)urea CAS Name: 1-[5-amino-3-phenyl-1-[4-(trifluoromethyl)phenyl]-4-pyrazolyl]-3-(pyridin-4-ylmethyl)urea IUPAC Name: 1-[5-amino-3-phenyl-1-[4-(trifluoromethyl)phenyl]pyrazol-4-yl]-3-(pyridin-4-ylmethyl)urea Traditional Name: 1-[5-amino-3-phenyl-1-[4-(trifluoromethyl)phenyl]pyrazol-4-yl]-3-(4-pyridylmethyl)urea Formula: C23H19F3N6O MolecularWeight: 452.43177

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C(=C2NC(=O)NCC3=CC=NC=C3)N)C4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C(=C2NC(=O)NCC3=CC=NC=C3)N)C4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C23H19F3N6O/c24-23(25,26)17-6-8-18(9-7-17)32-21(27)20(19(31-32)16-4-2-1-3-5-16)30-22(33)29-14-15-10-12-28-13-11-15/h1-13H,14,27H2,(H2,29,30,33)