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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)NC1=C(C(=NN1C2=CC=CC=C2C)C)C3=CC=CC=C3)C(=O)CSC4=CC=CC=C4

Isomeric SMILES

CCCCN(CC(=O)NC1=C(C(=NN1C2=CC=CC=C2C)C)C3=CC=CC=C3)C(=O)CSC4=CC=CC=C4

InChI

InChI=1S/C31H34N4O2S/c1-4-5-20-34(29(37)22-38-26-17-10-7-11-18-26)21-28(36)32-31-30(25-15-8-6-9-16-25)24(3)33-35(31)27-19-13-12-14-23(27)2/h6-19H,4-5,20-22H2,1-3H3,(H,32,36)