[(2S)-1-(tert-butylamino)-1-oxidanylidene-propan-2-yl] 5-phenylthiophene-2-carboxylate

Systemtic Name: [(2S)-1-(tert-butylamino)-1-oxidanylidene-propan-2-yl] 5-phenylthiophene-2-carboxylate Openeye Name: [(1S)-2-(tert-butylamino)-1-methyl-2-oxo-ethyl] 5-phenylthiophene-2-carboxylate CAS Name: 5-phenyl-2-thiophenecarboxylic acid [(2S)-1-(tert-butylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(tert-butylamino)-1-oxopropan-2-yl] 5-phenylthiophene-2-carboxylate Traditional Name: 5-phenylthiophene-2-carboxylic acid [(1S)-2-(tert-butylamino)-2-keto-1-methyl-ethyl] ester Formula: C18H21NO3S MolecularWeight: 331.42924

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C)(C)C)OC(=O)C1=CC=C(S1)C2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C18H21NO3S/c1-12(16(20)19-18(2,3)4)22-17(21)15-11-10-14(23-15)13-8-6-5-7-9-13/h5-12H,1-4H3,(H,19,20)/t12-/m0/s1