N-(2,5-ditert-butylpyrazol-3-yl)-2-[ethyl-[(4-nitrophenyl)carbamoyl]amino]ethanamide

Systemtic Name: N-(2,5-ditert-butylpyrazol-3-yl)-2-[ethyl-[(4-nitrophenyl)carbamoyl]amino]ethanamide Openeye Name: N-(2,5-ditert-butylpyrazol-3-yl)-2-[ethyl-[(4-nitrophenyl)carbamoyl]amino]acetamide CAS Name: N-(2,5-ditert-butyl-3-pyrazolyl)-2-[ethyl-[(4-nitroanilino)-oxomethyl]amino]acetamide IUPAC Name: N-(2,5-ditert-butylpyrazol-3-yl)-2-[ethyl-[(4-nitrophenyl)carbamoyl]amino]acetamide Traditional Name: N-(2,5-ditert-butylpyrazol-3-yl)-2-[ethyl-[(4-nitrophenyl)carbamoyl]amino]acetamide Formula: C22H32N6O4 MolecularWeight: 444.52728

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC1=CC(=NN1C(C)(C)C)C(C)(C)C)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCN(CC(=O)NC1=CC(=NN1C(C)(C)C)C(C)(C)C)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C22H32N6O4/c1-8-26(20(30)23-15-9-11-16(12-10-15)28(31)32)14-19(29)24-18-13-17(21(2,3)4)25-27(18)22(5,6)7/h9-13H,8,14H2,1-7H3,(H,23,30)(H,24,29)