N-[5-tert-butyl-2-(2,4-dimethylphenyl)pyrazol-3-yl]-2-[(3-cyanophenyl)carbamoylamino]ethanamide

Systemtic Name: N-[5-tert-butyl-2-(2,4-dimethylphenyl)pyrazol-3-yl]-2-[(3-cyanophenyl)carbamoylamino]ethanamide Openeye Name: N-[5-tert-butyl-2-(2,4-dimethylphenyl)pyrazol-3-yl]-2-[(3-cyanophenyl)carbamoylamino]acetamide CAS Name: N-[5-tert-butyl-2-(2,4-dimethylphenyl)-3-pyrazolyl]-2-[[(3-cyanoanilino)-oxomethyl]amino]acetamide IUPAC Name: N-[5-tert-butyl-2-(2,4-dimethylphenyl)pyrazol-3-yl]-2-[(3-cyanophenyl)carbamoylamino]acetamide Traditional Name: N-[5-tert-butyl-2-(2,4-dimethylphenyl)pyrazol-3-yl]-2-[(3-cyanophenyl)carbamoylamino]acetamide Formula: C25H28N6O2 MolecularWeight: 444.52882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)CNC(=O)NC3=CC=CC(=C3)C#N)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)CNC(=O)NC3=CC=CC(=C3)C#N)C

InChI

InChI=1S/C25H28N6O2/c1-16-9-10-20(17(2)11-16)31-22(13-21(30-31)25(3,4)5)29-23(32)15-27-24(33)28-19-8-6-7-18(12-19)14-26/h6-13H,15H2,1-5H3,(H,29,32)(H2,27,28,33)