[(2S)-1-oxidanylidene-1-(4-phenylpiperazin-1-yl)propan-2-yl] thiophene-3-carboxylate

Systemtic Name: [(2S)-1-oxidanylidene-1-(4-phenylpiperazin-1-yl)propan-2-yl] thiophene-3-carboxylate Openeye Name: [(1S)-1-methyl-2-oxo-2-(4-phenylpiperazin-1-yl)ethyl] thiophene-3-carboxylate CAS Name: 3-thiophenecarboxylic acid [(2S)-1-oxo-1-(4-phenyl-1-piperazinyl)propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-(4-phenylpiperazin-1-yl)propan-2-yl] thiophene-3-carboxylate Traditional Name: thiophene-3-carboxylic acid [(1S)-2-keto-1-methyl-2-(4-phenylpiperazino)ethyl] ester Formula: C18H20N2O3S MolecularWeight: 344.428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=CC=CC=C2)OC(=O)C3=CSC=C3

Isomeric SMILES

C[C@@H](C(=O)N1CCN(CC1)C2=CC=CC=C2)OC(=O)C3=CSC=C3

InChI

InChI=1S/C18H20N2O3S/c1-14(23-18(22)15-7-12-24-13-15)17(21)20-10-8-19(9-11-20)16-5-3-2-4-6-16/h2-7,12-14H,8-11H2,1H3/t14-/m0/s1