1-[5-azanyl-3-phenyl-1-[4-(trifluoromethyl)phenyl]pyrazol-4-yl]-3-(2-dimethylaminoethyl)urea

Systemtic Name: 1-[5-azanyl-3-phenyl-1-[4-(trifluoromethyl)phenyl]pyrazol-4-yl]-3-(2-dimethylaminoethyl)urea Openeye Name: 1-[5-amino-3-phenyl-1-[4-(trifluoromethyl)phenyl]pyrazol-4-yl]-3-(2-dimethylaminoethyl)urea CAS Name: 1-[5-amino-3-phenyl-1-[4-(trifluoromethyl)phenyl]-4-pyrazolyl]-3-(2-dimethylaminoethyl)urea IUPAC Name: 1-[5-amino-3-phenyl-1-[4-(trifluoromethyl)phenyl]pyrazol-4-yl]-3-(2-dimethylaminoethyl)urea Traditional Name: 1-[5-amino-3-phenyl-1-[4-(trifluoromethyl)phenyl]pyrazol-4-yl]-3-(2-dimethylaminoethyl)urea Formula: C21H23F3N6O MolecularWeight: 432.44213

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23F3N6O/c1-29(2)13-12-26-20(31)27-18-17(14-6-4-3-5-7-14)28-30(19(18)25)16-10-8-15(9-11-16)21(22,23)24/h3-11H,12-13,25H2,1-2H3,(H2,26,27,31)