[(2S)-1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 5-ethanoylthiophene-2-carboxylate

Systemtic Name: [(2S)-1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 5-ethanoylthiophene-2-carboxylate Openeye Name: [(1S)-2-(allylamino)-1-methyl-2-oxo-ethyl] 5-acetylthiophene-2-carboxylate CAS Name: 5-acetyl-2-thiophenecarboxylic acid [(2S)-1-oxo-1-(prop-2-enylamino)propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-(prop-2-enylamino)propan-2-yl] 5-acetylthiophene-2-carboxylate Traditional Name: 5-acetylthiophene-2-carboxylic acid [(1S)-2-(allylamino)-2-keto-1-methyl-ethyl] ester Formula: C13H15NO4S MolecularWeight: 281.3275

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC=C)OC(=O)C1=CC=C(S1)C(=O)C

Isomeric SMILES

C[C@@H](C(=O)NCC=C)OC(=O)C1=CC=C(S1)C(=O)C

InChI

InChI=1S/C13H15NO4S/c1-4-7-14-12(16)9(3)18-13(17)11-6-5-10(19-11)8(2)15/h4-6,9H,1,7H2,2-3H3,(H,14,16)/t9-/m0/s1