ethyl (4R,5R)-5-[1-(phenylsulfonyl)pyrrol-3-yl]-2-sulfanylidene-1,3-oxazolidine-4-carboxylate

Systemtic Name: ethyl (4R,5R)-5-[1-(phenylsulfonyl)pyrrol-3-yl]-2-sulfanylidene-1,3-oxazolidine-4-carboxylate Openeye Name: ethyl (4R,5R)-5-[1-(benzenesulfonyl)pyrrol-3-yl]-2-thioxo-oxazolidine-4-carboxylate CAS Name: (4R,5R)-5-[1-(benzenesulfonyl)-3-pyrrolyl]-2-sulfanylidene-4-oxazolidinecarboxylic acid ethyl ester IUPAC Name: ethyl (4R,5R)-5-[1-(benzenesulfonyl)pyrrol-3-yl]-2-sulfanylidene-1,3-oxazolidine-4-carboxylate Traditional Name: (4R,5R)-5-(1-besylpyrrol-3-yl)-2-thioxo-oxazolidine-4-carboxylic acid ethyl ester Formula: C16H16N2O5S2 MolecularWeight: 380.43864

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(OC(=S)N1)C2=CN(C=C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)[C@H]1[C@H](OC(=S)N1)C2=CN(C=C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C16H16N2O5S2/c1-2-22-15(19)13-14(23-16(24)17-13)11-8-9-18(10-11)25(20,21)12-6-4-3-5-7-12/h3-10,13-14H,2H2,1H3,(H,17,24)/t13-,14-/m1/s1