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

Systemtic Name: 1-[5-azanyl-3-phenyl-1-[4-(trifluoromethyl)phenyl]pyrazol-4-yl]-3-morpholin-4-yl-urea Openeye Name: 1-[5-amino-3-phenyl-1-[4-(trifluoromethyl)phenyl]pyrazol-4-yl]-3-morpholino-urea CAS Name: 1-[5-amino-3-phenyl-1-[4-(trifluoromethyl)phenyl]-4-pyrazolyl]-3-(4-morpholinyl)urea IUPAC Name: 1-[5-amino-3-phenyl-1-[4-(trifluoromethyl)phenyl]pyrazol-4-yl]-3-morpholin-4-ylurea Traditional Name: 1-[5-amino-3-phenyl-1-[4-(trifluoromethyl)phenyl]pyrazol-4-yl]-3-morpholino-urea Formula: C21H21F3N6O2 MolecularWeight: 446.42565

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1NC(=O)NC2=C(N(N=C2C3=CC=CC=C3)C4=CC=C(C=C4)C(F)(F)F)N

Isomeric SMILES

C1COCCN1NC(=O)NC2=C(N(N=C2C3=CC=CC=C3)C4=CC=C(C=C4)C(F)(F)F)N

InChI

InChI=1S/C21H21F3N6O2/c22-21(23,24)15-6-8-16(9-7-15)30-19(25)18(17(27-30)14-4-2-1-3-5-14)26-20(31)28-29-10-12-32-13-11-29/h1-9H,10-13,25H2,(H2,26,28,31)