ethyl (2S,3R)-5-azanyl-3-phenyl-2-(phenylcarbonyl)-2,3-dihydrothiophene-4-carboxylate

Systemtic Name: ethyl (2S,3R)-5-azanyl-3-phenyl-2-(phenylcarbonyl)-2,3-dihydrothiophene-4-carboxylate Openeye Name: ethyl (2S,3R)-5-amino-2-benzoyl-3-phenyl-2,3-dihydrothiophene-4-carboxylate CAS Name: (2S,3R)-5-amino-2-benzoyl-3-phenyl-2,3-dihydrothiophene-4-carboxylic acid ethyl ester IUPAC Name: ethyl (2S,3R)-5-amino-2-benzoyl-3-phenyl-2,3-dihydrothiophene-4-carboxylate Traditional Name: (2S,3R)-5-amino-2-benzoyl-3-phenyl-2,3-dihydrothiophene-4-carboxylic acid ethyl ester Formula: C20H19NO3S MolecularWeight: 353.43476

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(C1C2=CC=CC=C2)C(=O)C3=CC=CC=C3)N

Isomeric SMILES

CCOC(=O)C1=C(S[C@@H]([C@@H]1C2=CC=CC=C2)C(=O)C3=CC=CC=C3)N

InChI

InChI=1S/C20H19NO3S/c1-2-24-20(23)16-15(13-9-5-3-6-10-13)18(25-19(16)21)17(22)14-11-7-4-8-12-14/h3-12,15,18H,2,21H2,1H3/t15-,18+/m1/s1