N-[5-tert-butyl-2-(2,4-dimethylphenyl)pyrazol-3-yl]-2-[(4-nitrophenyl)carbamoyl-pentyl-amino]ethanamide

Systemtic Name: N-[5-tert-butyl-2-(2,4-dimethylphenyl)pyrazol-3-yl]-2-[(4-nitrophenyl)carbamoyl-pentyl-amino]ethanamide Openeye Name: N-[5-tert-butyl-2-(2,4-dimethylphenyl)pyrazol-3-yl]-2-[(4-nitrophenyl)carbamoyl-pentyl-amino]acetamide CAS Name: N-[5-tert-butyl-2-(2,4-dimethylphenyl)-3-pyrazolyl]-2-[[(4-nitroanilino)-oxomethyl]-pentylamino]acetamide IUPAC Name: N-[5-tert-butyl-2-(2,4-dimethylphenyl)pyrazol-3-yl]-2-[(4-nitrophenyl)carbamoyl-pentylamino]acetamide Traditional Name: 2-[amyl-[(4-nitrophenyl)carbamoyl]amino]-N-[5-tert-butyl-2-(2,4-dimethylphenyl)pyrazol-3-yl]acetamide Formula: C29H38N6O4 MolecularWeight: 534.64982

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC(=O)NC1=CC(=NN1C2=C(C=C(C=C2)C)C)C(C)(C)C)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCCN(CC(=O)NC1=CC(=NN1C2=C(C=C(C=C2)C)C)C(C)(C)C)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C29H38N6O4/c1-7-8-9-16-33(28(37)30-22-11-13-23(14-12-22)35(38)39)19-27(36)31-26-18-25(29(4,5)6)32-34(26)24-15-10-20(2)17-21(24)3/h10-15,17-18H,7-9,16,19H2,1-6H3,(H,30,37)(H,31,36)