1-[5-azanyl-3-(4-methoxyphenyl)-1-[4-(trifluoromethyl)phenyl]pyrazol-4-yl]-3-phenethyl-urea

Systemtic Name: 1-[5-azanyl-3-(4-methoxyphenyl)-1-[4-(trifluoromethyl)phenyl]pyrazol-4-yl]-3-phenethyl-urea Openeye Name: 1-[5-amino-3-(4-methoxyphenyl)-1-[4-(trifluoromethyl)phenyl]pyrazol-4-yl]-3-phenethyl-urea CAS Name: 1-[5-amino-3-(4-methoxyphenyl)-1-[4-(trifluoromethyl)phenyl]-4-pyrazolyl]-3-phenethylurea IUPAC Name: 1-[5-amino-3-(4-methoxyphenyl)-1-[4-(trifluoromethyl)phenyl]pyrazol-4-yl]-3-phenethylurea Traditional Name: 1-[5-amino-3-(4-methoxyphenyl)-1-[4-(trifluoromethyl)phenyl]pyrazol-4-yl]-3-phenethyl-urea Formula: C26H24F3N5O2 MolecularWeight: 495.49627

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C(=C2NC(=O)NCCC3=CC=CC=C3)N)C4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C(=C2NC(=O)NCCC3=CC=CC=C3)N)C4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C26H24F3N5O2/c1-36-21-13-7-18(8-14-21)22-23(32-25(35)31-16-15-17-5-3-2-4-6-17)24(30)34(33-22)20-11-9-19(10-12-20)26(27,28)29/h2-14H,15-16,30H2,1H3,(H2,31,32,35)