1-[4-(azepan-1-ylsulfonyl)-3,5-dimethyl-pyrazol-1-yl]-2-cyclohexyl-ethanone

Systemtic Name: 1-[4-(azepan-1-ylsulfonyl)-3,5-dimethyl-pyrazol-1-yl]-2-cyclohexyl-ethanone Openeye Name: 1-[4-(azepan-1-ylsulfonyl)-3,5-dimethyl-pyrazol-1-yl]-2-cyclohexyl-ethanone CAS Name: 1-[4-(1-azepanylsulfonyl)-3,5-dimethyl-1-pyrazolyl]-2-cyclohexylethanone IUPAC Name: 1-[4-(azepan-1-ylsulfonyl)-3,5-dimethylpyrazol-1-yl]-2-cyclohexylethanone Traditional Name: 1-[4-(azepan-1-ylsulfonyl)-3,5-dimethyl-pyrazol-1-yl]-2-cyclohexyl-ethanone Formula: C19H31N3O3S MolecularWeight: 381.53274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(=O)CC2CCCCC2)C)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C(=NN1C(=O)CC2CCCCC2)C)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C19H31N3O3S/c1-15-19(26(24,25)21-12-8-3-4-9-13-21)16(2)22(20-15)18(23)14-17-10-6-5-7-11-17/h17H,3-14H2,1-2H3