[2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl] (2R)-1-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperidine-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl] (2R)-1-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperidine-2-carboxylate Openeye Name: [2-(allylcarbamoylamino)-2-oxo-ethyl] (2R)-1-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperidine-2-carboxylate CAS Name: (2R)-1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-2-piperidinecarboxylic acid [2-oxo-2-[[oxo-(prop-2-enylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-enylcarbamoylamino)ethyl] (2R)-1-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperidine-2-carboxylate Traditional Name: (2R)-1-piazthiol-4-ylsulfonylpipecolinic acid [2-(allylcarbamoylamino)-2-keto-ethyl] ester Formula: C18H21N5O6S2 MolecularWeight: 467.51924

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)NC(=O)COC(=O)C1CCCCN1S(=O)(=O)C2=CC=CC3=NSN=C32

Isomeric SMILES

C=CCNC(=O)NC(=O)COC(=O)[C@H]1CCCCN1S(=O)(=O)C2=CC=CC3=NSN=C32

InChI

InChI=1S/C18H21N5O6S2/c1-2-9-19-18(26)20-15(24)11-29-17(25)13-7-3-4-10-23(13)31(27,28)14-8-5-6-12-16(14)22-30-21-12/h2,5-6,8,13H,1,3-4,7,9-11H2,(H2,19,20,24,26)/t13-/m1/s1