N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]-2-phenylsulfanyl-ethanamide

Systemtic Name: N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]-2-phenylsulfanyl-ethanamide Openeye Name: N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]-2-phenylsulfanyl-acetamide CAS Name: N-[5-tert-butyl-2-(4-methoxyphenyl)-3-pyrazolyl]-2-(phenylthio)acetamide IUPAC Name: N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]-2-phenylsulfanylacetamide Traditional Name: N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]-2-(phenylthio)acetamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)CSC2=CC=CC=C2)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)CSC2=CC=CC=C2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H25N3O2S/c1-22(2,3)19-14-20(23-21(26)15-28-18-8-6-5-7-9-18)25(24-19)16-10-12-17(27-4)13-11-16/h5-14H,15H2,1-4H3,(H,23,26)