2-[(4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methylsulfanyl]-N-(4-phenoxyphenyl)ethanamide

Systemtic Name: 2-[(4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methylsulfanyl]-N-(4-phenoxyphenyl)ethanamide Openeye Name: 2-[(4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methylsulfanyl]-N-(4-phenoxyphenyl)acetamide CAS Name: 2-[(4-cyano-5-methyl-2-phenyl-3-pyrazolyl)methylthio]-N-(4-phenoxyphenyl)acetamide IUPAC Name: 2-[(4-cyano-5-methyl-2-phenylpyrazol-3-yl)methylsulfanyl]-N-(4-phenoxyphenyl)acetamide Traditional Name: 2-[(4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methylthio]-N-(4-phenoxyphenyl)acetamide Formula: C26H22N4O2S MolecularWeight: 454.54348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C#N)CSCC(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C#N)CSCC(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H22N4O2S/c1-19-24(16-27)25(30(29-19)21-8-4-2-5-9-21)17-33-18-26(31)28-20-12-14-23(15-13-20)32-22-10-6-3-7-11-22/h2-15H,17-18H2,1H3,(H,28,31)