N-(2-cyclopentylpyrazol-3-yl)-2-[1-(3,4-dimethylphenyl)imidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(2-cyclopentylpyrazol-3-yl)-2-[1-(3,4-dimethylphenyl)imidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-(2-cyclopentylpyrazol-3-yl)-2-[1-(3,4-dimethylphenyl)imidazol-2-yl]sulfanyl-acetamide CAS Name: N-(2-cyclopentyl-3-pyrazolyl)-2-[[1-(3,4-dimethylphenyl)-2-imidazolyl]thio]acetamide IUPAC Name: N-(2-cyclopentylpyrazol-3-yl)-2-[1-(3,4-dimethylphenyl)imidazol-2-yl]sulfanylacetamide Traditional Name: N-(2-cyclopentylpyrazol-3-yl)-2-[[1-(3,4-dimethylphenyl)imidazol-2-yl]thio]acetamide Formula: C21H25N5OS MolecularWeight: 395.5211

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C=CN=C2SCC(=O)NC3=CC=NN3C4CCCC4)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C=CN=C2SCC(=O)NC3=CC=NN3C4CCCC4)C

InChI

InChI=1S/C21H25N5OS/c1-15-7-8-18(13-16(15)2)25-12-11-22-21(25)28-14-20(27)24-19-9-10-23-26(19)17-5-3-4-6-17/h7-13,17H,3-6,14H2,1-2H3,(H,24,27)