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

Systemtic Name: N-(2-cyclopentylsulfanylphenyl)-2-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]ethanamide Openeye Name: N-(2-cyclopentylsulfanylphenyl)-2-(1-isobutyl-3,5-dimethyl-pyrazol-4-yl)acetamide CAS Name: N-[2-(cyclopentylthio)phenyl]-2-[3,5-dimethyl-1-(2-methylpropyl)-4-pyrazolyl]acetamide IUPAC Name: N-(2-cyclopentylsulfanylphenyl)-2-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]acetamide Traditional Name: N-[2-(cyclopentylthio)phenyl]-2-(1-isobutyl-3,5-dimethyl-pyrazol-4-yl)acetamide Formula: C22H31N3OS MolecularWeight: 385.56604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(C)C)C)CC(=O)NC2=CC=CC=C2SC3CCCC3

Isomeric SMILES

CC1=C(C(=NN1CC(C)C)C)CC(=O)NC2=CC=CC=C2SC3CCCC3

InChI

InChI=1S/C22H31N3OS/c1-15(2)14-25-17(4)19(16(3)24-25)13-22(26)23-20-11-7-8-12-21(20)27-18-9-5-6-10-18/h7-8,11-12,15,18H,5-6,9-10,13-14H2,1-4H3,(H,23,26)