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

Systemtic Name: [(2R)-1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] (2S)-1-thiophen-2-ylcarbonylpyrrolidine-2-carboxylate Openeye Name: [(1R)-1-allophanoyl-2-methyl-propyl] (2S)-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxylate CAS Name: (2S)-1-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinecarboxylic acid [(2R)-1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [(2R)-1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] (2S)-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxylate Traditional Name: (2S)-1-(2-thenoyl)pyrrolidine-2-carboxylic acid [(1R)-1-allophanoyl-2-methyl-propyl] ester Formula: C16H21N3O5S MolecularWeight: 367.42004

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(=O)N)OC(=O)C1CCCN1C(=O)C2=CC=CS2

Isomeric SMILES

CC(C)[C@H](C(=O)NC(=O)N)OC(=O)[C@@H]1CCCN1C(=O)C2=CC=CS2

InChI

InChI=1S/C16H21N3O5S/c1-9(2)12(13(20)18-16(17)23)24-15(22)10-5-3-7-19(10)14(21)11-6-4-8-25-11/h4,6,8-10,12H,3,5,7H2,1-2H3,(H3,17,18,20,23)/t10-,12+/m0/s1