2-[(3-chloranyl-4-fluoranyl-phenyl)carbamoyl-propan-2-yl-amino]-N-(2,5-ditert-butylpyrazol-3-yl)ethanamide

Systemtic Name: 2-[(3-chloranyl-4-fluoranyl-phenyl)carbamoyl-propan-2-yl-amino]-N-(2,5-ditert-butylpyrazol-3-yl)ethanamide Openeye Name: 2-[(3-chloro-4-fluoro-phenyl)carbamoyl-isopropyl-amino]-N-(2,5-ditert-butylpyrazol-3-yl)acetamide CAS Name: 2-[[(3-chloro-4-fluoroanilino)-oxomethyl]-propan-2-ylamino]-N-(2,5-ditert-butyl-3-pyrazolyl)acetamide IUPAC Name: 2-[(3-chloro-4-fluorophenyl)carbamoyl-propan-2-ylamino]-N-(2,5-ditert-butylpyrazol-3-yl)acetamide Traditional Name: 2-[(3-chloro-4-fluoro-phenyl)carbamoyl-isopropyl-amino]-N-(2,5-ditert-butylpyrazol-3-yl)acetamide Formula: C23H33ClFN5O2 MolecularWeight: 465.991823

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC(=O)NC1=CC(=NN1C(C)(C)C)C(C)(C)C)C(=O)NC2=CC(=C(C=C2)F)Cl

Isomeric SMILES

CC(C)N(CC(=O)NC1=CC(=NN1C(C)(C)C)C(C)(C)C)C(=O)NC2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C23H33ClFN5O2/c1-14(2)29(21(32)26-15-9-10-17(25)16(24)11-15)13-20(31)27-19-12-18(22(3,4)5)28-30(19)23(6,7)8/h9-12,14H,13H2,1-8H3,(H,26,32)(H,27,31)