N-[5-tert-butyl-2-(2-methylphenyl)pyrazol-3-yl]-2-phenylsulfanyl-ethanamide

Systemtic Name: N-[5-tert-butyl-2-(2-methylphenyl)pyrazol-3-yl]-2-phenylsulfanyl-ethanamide Openeye Name: N-[5-tert-butyl-2-(o-tolyl)pyrazol-3-yl]-2-phenylsulfanyl-acetamide CAS Name: N-[5-tert-butyl-2-(2-methylphenyl)-3-pyrazolyl]-2-(phenylthio)acetamide IUPAC Name: N-[5-tert-butyl-2-(2-methylphenyl)pyrazol-3-yl]-2-phenylsulfanylacetamide Traditional Name: N-[5-tert-butyl-2-(o-tolyl)pyrazol-3-yl]-2-(phenylthio)acetamide Formula: C22H25N3OS MolecularWeight: 379.5184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=CC(=N2)C(C)(C)C)NC(=O)CSC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1N2C(=CC(=N2)C(C)(C)C)NC(=O)CSC3=CC=CC=C3

InChI

InChI=1S/C22H25N3OS/c1-16-10-8-9-13-18(16)25-20(14-19(24-25)22(2,3)4)23-21(26)15-27-17-11-6-5-7-12-17/h5-14H,15H2,1-4H3,(H,23,26)