ethyl 1-[[3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl]piperidine-2-carboxylate

Systemtic Name: ethyl 1-[[3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl]piperidine-2-carboxylate Openeye Name: ethyl 1-[[3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl]piperidine-2-carboxylate CAS Name: 1-[[3-butyl-2-(cyclobutylmethylsulfonyl)-4-imidazolyl]methyl]-2-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl]piperidine-2-carboxylate Traditional Name: 1-[[3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl]pipecolinic acid ethyl ester Formula: C21H35N3O4S MolecularWeight: 425.5853

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CN=C1S(=O)(=O)CC2CCC2)CN3CCCCC3C(=O)OCC

Isomeric SMILES

CCCCN1C(=CN=C1S(=O)(=O)CC2CCC2)CN3CCCCC3C(=O)OCC

InChI

InChI=1S/C21H35N3O4S/c1-3-5-13-24-18(14-22-21(24)29(26,27)16-17-9-8-10-17)15-23-12-7-6-11-19(23)20(25)28-4-2/h14,17,19H,3-13,15-16H2,1-2H3