[(2S)-1-oxidanylidene-1-phenyl-propan-2-yl] 3-pyrrol-1-ylthiophene-2-carboxylate

Systemtic Name: [(2S)-1-oxidanylidene-1-phenyl-propan-2-yl] 3-pyrrol-1-ylthiophene-2-carboxylate Openeye Name: [(1S)-1-methyl-2-oxo-2-phenyl-ethyl] 3-pyrrol-1-ylthiophene-2-carboxylate CAS Name: 3-(1-pyrrolyl)-2-thiophenecarboxylic acid [(2S)-1-oxo-1-phenylpropan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-phenylpropan-2-yl] 3-pyrrol-1-ylthiophene-2-carboxylate Traditional Name: 3-pyrrol-1-ylthiophene-2-carboxylic acid [(1S)-2-keto-1-methyl-2-phenyl-ethyl] ester Formula: C18H15NO3S MolecularWeight: 325.3816

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=CC=C1)OC(=O)C2=C(C=CS2)N3C=CC=C3

Isomeric SMILES

C[C@@H](C(=O)C1=CC=CC=C1)OC(=O)C2=C(C=CS2)N3C=CC=C3

InChI

InChI=1S/C18H15NO3S/c1-13(16(20)14-7-3-2-4-8-14)22-18(21)17-15(9-12-23-17)19-10-5-6-11-19/h2-13H,1H3/t13-/m0/s1