tert-butyl 2-carbamimidoyl-4-[2-[5-(methylsulfonyloxymethyl)-2-oxidanylidene-1,3-oxazolidin-3-yl]ethyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 2-carbamimidoyl-4-[2-[5-(methylsulfonyloxymethyl)-2-oxidanylidene-1,3-oxazolidin-3-yl]ethyl]piperazine-1-carboxylate Openeye Name: tert-butyl 2-carbamimidoyl-4-[2-[5-(methylsulfonyloxymethyl)-2-oxo-oxazolidin-3-yl]ethyl]piperazine-1-carboxylate CAS Name: 2-carbamimidoyl-4-[2-[5-(methylsulfonyloxymethyl)-2-oxo-3-oxazolidinyl]ethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-carbamimidoyl-4-[2-[5-(methylsulfonyloxymethyl)-2-oxo-1,3-oxazolidin-3-yl]ethyl]piperazine-1-carboxylate Traditional Name: 2-amidino-4-[2-[2-keto-5-(methylsulfonyloxymethyl)oxazolidin-3-yl]ethyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C17H31N5O7S MolecularWeight: 449.52234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1C(=N)N)CCN2CC(OC2=O)COS(=O)(=O)C

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1C(=N)N)CCN2CC(OC2=O)COS(=O)(=O)C

InChI

InChI=1S/C17H31N5O7S/c1-17(2,3)29-16(24)22-8-6-20(10-13(22)14(18)19)5-7-21-9-12(28-15(21)23)11-27-30(4,25)26/h12-13H,5-11H2,1-4H3,(H3,18,19)