N-[5-methyl-2-(2-methylphenyl)-4-phenyl-pyrazol-3-yl]-2-[2-methylpropyl(2-phenylsulfanylethanoyl)amino]ethanamide

Systemtic Name: N-[5-methyl-2-(2-methylphenyl)-4-phenyl-pyrazol-3-yl]-2-[2-methylpropyl(2-phenylsulfanylethanoyl)amino]ethanamide Openeye Name: 2-[isobutyl-(2-phenylsulfanylacetyl)amino]-N-[5-methyl-2-(o-tolyl)-4-phenyl-pyrazol-3-yl]acetamide CAS Name: N-[5-methyl-2-(2-methylphenyl)-4-phenyl-3-pyrazolyl]-2-[2-methylpropyl-[1-oxo-2-(phenylthio)ethyl]amino]acetamide IUPAC Name: N-[5-methyl-2-(2-methylphenyl)-4-phenylpyrazol-3-yl]-2-[2-methylpropyl-(2-phenylsulfanylacetyl)amino]acetamide Traditional Name: 2-[isobutyl-[2-(phenylthio)acetyl]amino]-N-[5-methyl-2-(o-tolyl)-4-phenyl-pyrazol-3-yl]acetamide Formula: C31H34N4O2S MolecularWeight: 526.69226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=C(C(=N2)C)C3=CC=CC=C3)NC(=O)CN(CC(C)C)C(=O)CSC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1N2C(=C(C(=N2)C)C3=CC=CC=C3)NC(=O)CN(CC(C)C)C(=O)CSC4=CC=CC=C4

InChI

InChI=1S/C31H34N4O2S/c1-22(2)19-34(29(37)21-38-26-16-9-6-10-17-26)20-28(36)32-31-30(25-14-7-5-8-15-25)24(4)33-35(31)27-18-12-11-13-23(27)3/h5-18,22H,19-21H2,1-4H3,(H,32,36)