N-[5-tert-butyl-2-(phenylmethyl)pyrazol-3-yl]-3-(2-phenylethanoylamino)propanamide

Systemtic Name: N-[5-tert-butyl-2-(phenylmethyl)pyrazol-3-yl]-3-(2-phenylethanoylamino)propanamide Openeye Name: N-(2-benzyl-5-tert-butyl-pyrazol-3-yl)-3-[(2-phenylacetyl)amino]propanamide CAS Name: N-[5-tert-butyl-2-(phenylmethyl)-3-pyrazolyl]-3-[(1-oxo-2-phenylethyl)amino]propanamide IUPAC Name: N-(2-benzyl-5-tert-butylpyrazol-3-yl)-3-[(2-phenylacetyl)amino]propanamide Traditional Name: N-(2-benzyl-5-tert-butyl-pyrazol-3-yl)-3-[(2-phenylacetyl)amino]propionamide Formula: C25H30N4O2 MolecularWeight: 418.5313

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)CCNC(=O)CC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)CCNC(=O)CC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C25H30N4O2/c1-25(2,3)21-17-22(29(28-21)18-20-12-8-5-9-13-20)27-23(30)14-15-26-24(31)16-19-10-6-4-7-11-19/h4-13,17H,14-16,18H2,1-3H3,(H,26,31)(H,27,30)