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

Systemtic Name: N-(2,5-ditert-butylpyrazol-3-yl)-2-[(4-nitrophenyl)carbamoyl-propan-2-yl-amino]ethanamide Openeye Name: N-(2,5-ditert-butylpyrazol-3-yl)-2-[isopropyl-[(4-nitrophenyl)carbamoyl]amino]acetamide CAS Name: N-(2,5-ditert-butyl-3-pyrazolyl)-2-[[(4-nitroanilino)-oxomethyl]-propan-2-ylamino]acetamide IUPAC Name: N-(2,5-ditert-butylpyrazol-3-yl)-2-[(4-nitrophenyl)carbamoyl-propan-2-ylamino]acetamide Traditional Name: N-(2,5-ditert-butylpyrazol-3-yl)-2-[isopropyl-[(4-nitrophenyl)carbamoyl]amino]acetamide Formula: C23H34N6O4 MolecularWeight: 458.55386

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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)[N+](=O)[O-]

Isomeric SMILES

CC(C)N(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/C23H34N6O4/c1-15(2)27(21(31)24-16-9-11-17(12-10-16)29(32)33)14-20(30)25-19-13-18(22(3,4)5)26-28(19)23(6,7)8/h9-13,15H,14H2,1-8H3,(H,24,31)(H,25,30)