N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)ethanamide

Systemtic Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)ethanamide Openeye Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)acetamide CAS Name: N-[2-[(2-cyanophenyl)methylthio]ethyl]-2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)acetamide IUPAC Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-(3,5-dimethyl-1-phenylpyrazol-4-yl)acetamide Traditional Name: N-[2-[(2-cyanobenzyl)thio]ethyl]-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)acetamide Formula: C23H24N4OS MolecularWeight: 404.52786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CC(=O)NCCSCC3=CC=CC=C3C#N

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CC(=O)NCCSCC3=CC=CC=C3C#N

InChI

InChI=1S/C23H24N4OS/c1-17-22(18(2)27(26-17)21-10-4-3-5-11-21)14-23(28)25-12-13-29-16-20-9-7-6-8-19(20)15-24/h3-11H,12-14,16H2,1-2H3,(H,25,28)