N-(2-cyclopentylpyrazol-3-yl)-2-(3,4-dimethylphenyl)sulfanyl-ethanamide

Systemtic Name: N-(2-cyclopentylpyrazol-3-yl)-2-(3,4-dimethylphenyl)sulfanyl-ethanamide Openeye Name: N-(2-cyclopentylpyrazol-3-yl)-2-(3,4-dimethylphenyl)sulfanyl-acetamide CAS Name: N-(2-cyclopentyl-3-pyrazolyl)-2-[(3,4-dimethylphenyl)thio]acetamide IUPAC Name: N-(2-cyclopentylpyrazol-3-yl)-2-(3,4-dimethylphenyl)sulfanylacetamide Traditional Name: N-(2-cyclopentylpyrazol-3-yl)-2-[(3,4-dimethylphenyl)thio]acetamide Formula: C18H23N3OS MolecularWeight: 329.45972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCC(=O)NC2=CC=NN2C3CCCC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCC(=O)NC2=CC=NN2C3CCCC3)C

InChI

InChI=1S/C18H23N3OS/c1-13-7-8-16(11-14(13)2)23-12-18(22)20-17-9-10-19-21(17)15-5-3-4-6-15/h7-11,15H,3-6,12H2,1-2H3,(H,20,22)