2-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]-N-(2-prop-2-enylsulfanylphenyl)ethanamide

Systemtic Name: 2-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]-N-(2-prop-2-enylsulfanylphenyl)ethanamide Openeye Name: N-(2-allylsulfanylphenyl)-2-(1-isobutyl-3,5-dimethyl-pyrazol-4-yl)acetamide CAS Name: 2-[3,5-dimethyl-1-(2-methylpropyl)-4-pyrazolyl]-N-[2-(prop-2-enylthio)phenyl]acetamide IUPAC Name: 2-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]-N-(2-prop-2-enylsulfanylphenyl)acetamide Traditional Name: N-[2-(allylthio)phenyl]-2-(1-isobutyl-3,5-dimethyl-pyrazol-4-yl)acetamide Formula: C20H27N3OS MolecularWeight: 357.51288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(C)C)C)CC(=O)NC2=CC=CC=C2SCC=C

Isomeric SMILES

CC1=C(C(=NN1CC(C)C)C)CC(=O)NC2=CC=CC=C2SCC=C

InChI

InChI=1S/C20H27N3OS/c1-6-11-25-19-10-8-7-9-18(19)21-20(24)12-17-15(4)22-23(16(17)5)13-14(2)3/h6-10,14H,1,11-13H2,2-5H3,(H,21,24)