[(2R)-1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 1-thiophen-2-ylcarbonylpiperidine-4-carboxylate

Systemtic Name: [(2R)-1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 1-thiophen-2-ylcarbonylpiperidine-4-carboxylate Openeye Name: [(1R)-1-allophanoyl-2-methyl-propyl] 1-(thiophene-2-carbonyl)piperidine-4-carboxylate CAS Name: 1-[oxo(thiophen-2-yl)methyl]-4-piperidinecarboxylic acid [(2R)-1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [(2R)-1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] 1-(thiophene-2-carbonyl)piperidine-4-carboxylate Traditional Name: 1-(2-thenoyl)isonipecotic acid [(1R)-1-allophanoyl-2-methyl-propyl] ester Formula: C17H23N3O5S MolecularWeight: 381.44662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(=O)N)OC(=O)C1CCN(CC1)C(=O)C2=CC=CS2

Isomeric SMILES

CC(C)[C@H](C(=O)NC(=O)N)OC(=O)C1CCN(CC1)C(=O)C2=CC=CS2

InChI

InChI=1S/C17H23N3O5S/c1-10(2)13(14(21)19-17(18)24)25-16(23)11-5-7-20(8-6-11)15(22)12-4-3-9-26-12/h3-4,9-11,13H,5-8H2,1-2H3,(H3,18,19,21,24)/t13-/m1/s1