N-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-2-[2-phenylsulfanylethanoyl(propyl)amino]ethanamide

Systemtic Name: N-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-2-[2-phenylsulfanylethanoyl(propyl)amino]ethanamide Openeye Name: N-[5-tert-butyl-2-(p-tolyl)pyrazol-3-yl]-2-[(2-phenylsulfanylacetyl)-propyl-amino]acetamide CAS Name: N-[5-tert-butyl-2-(4-methylphenyl)-3-pyrazolyl]-2-[[1-oxo-2-(phenylthio)ethyl]-propylamino]acetamide IUPAC Name: N-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-2-[(2-phenylsulfanylacetyl)-propylamino]acetamide Traditional Name: N-[5-tert-butyl-2-(p-tolyl)pyrazol-3-yl]-2-[[2-(phenylthio)acetyl]-propyl-amino]acetamide Formula: C27H34N4O2S MolecularWeight: 478.64946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(=O)NC1=CC(=NN1C2=CC=C(C=C2)C)C(C)(C)C)C(=O)CSC3=CC=CC=C3

Isomeric SMILES

CCCN(CC(=O)NC1=CC(=NN1C2=CC=C(C=C2)C)C(C)(C)C)C(=O)CSC3=CC=CC=C3

InChI

InChI=1S/C27H34N4O2S/c1-6-16-30(26(33)19-34-22-10-8-7-9-11-22)18-25(32)28-24-17-23(27(3,4)5)29-31(24)21-14-12-20(2)13-15-21/h7-15,17H,6,16,18-19H2,1-5H3,(H,28,32)