[(2R)-1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl] 5-fluoranyl-1-benzothiophene-2-carboxylate

Systemtic Name: [(2R)-1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl] 5-fluoranyl-1-benzothiophene-2-carboxylate Openeye Name: [(1R)-1-methyl-2-oxo-2-ureido-ethyl] 5-fluorobenzothiophene-2-carboxylate CAS Name: 5-fluoro-1-benzothiophene-2-carboxylic acid [(2R)-1-(carbamoylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(carbamoylamino)-1-oxopropan-2-yl] 5-fluoro-1-benzothiophene-2-carboxylate Traditional Name: 5-fluorobenzothiophene-2-carboxylic acid [(1R)-2-keto-1-methyl-2-ureido-ethyl] ester Formula: C13H11FN2O4S MolecularWeight: 310.300843

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)N)OC(=O)C1=CC2=C(S1)C=CC(=C2)F

Isomeric SMILES

C[C@H](C(=O)NC(=O)N)OC(=O)C1=CC2=C(S1)C=CC(=C2)F

InChI

InChI=1S/C13H11FN2O4S/c1-6(11(17)16-13(15)19)20-12(18)10-5-7-4-8(14)2-3-9(7)21-10/h2-6H,1H3,(H3,15,16,17,19)/t6-/m1/s1