ethyl 4-[[2-methylsulfonyl-3-(oxolan-2-ylmethyl)imidazol-4-yl]methyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[[2-methylsulfonyl-3-(oxolan-2-ylmethyl)imidazol-4-yl]methyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[[2-methylsulfonyl-3-(tetrahydrofuran-2-ylmethyl)imidazol-4-yl]methyl]piperazine-1-carboxylate CAS Name: 4-[[2-methylsulfonyl-3-(2-oxolanylmethyl)-4-imidazolyl]methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-methylsulfonyl-3-(oxolan-2-ylmethyl)imidazol-4-yl]methyl]piperazine-1-carboxylate Traditional Name: 4-[[2-mesyl-3-(tetrahydrofurfuryl)imidazol-4-yl]methyl]piperazine-1-carboxylic acid ethyl ester Formula: C17H28N4O5S MolecularWeight: 400.49302

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)CC2=CN=C(N2CC3CCCO3)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)CC2=CN=C(N2CC3CCCO3)S(=O)(=O)C

InChI

InChI=1S/C17H28N4O5S/c1-3-25-17(22)20-8-6-19(7-9-20)12-14-11-18-16(27(2,23)24)21(14)13-15-5-4-10-26-15/h11,15H,3-10,12-13H2,1-2H3