ethyl 3-[3-tert-butyl-5-[(4-fluorophenyl)carbamoylamino]pyrazol-1-yl]benzoate

Systemtic Name: ethyl 3-[3-tert-butyl-5-[(4-fluorophenyl)carbamoylamino]pyrazol-1-yl]benzoate Openeye Name: ethyl 3-[3-tert-butyl-5-[(4-fluorophenyl)carbamoylamino]pyrazol-1-yl]benzoate CAS Name: 3-[3-tert-butyl-5-[[(4-fluoroanilino)-oxomethyl]amino]-1-pyrazolyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-[3-tert-butyl-5-[(4-fluorophenyl)carbamoylamino]pyrazol-1-yl]benzoate Traditional Name: 3-[3-tert-butyl-5-[(4-fluorophenyl)carbamoylamino]pyrazol-1-yl]benzoic acid ethyl ester Formula: C23H25FN4O3 MolecularWeight: 424.468003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C23H25FN4O3/c1-5-31-21(29)15-7-6-8-18(13-15)28-20(14-19(27-28)23(2,3)4)26-22(30)25-17-11-9-16(24)10-12-17/h6-14H,5H2,1-4H3,(H2,25,26,30)