methyl 4-[2-[(3R)-2,5-bis(oxidanylidene)-1-phenyl-pyrrolidin-3-yl]sulfanylethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[(3R)-2,5-bis(oxidanylidene)-1-phenyl-pyrrolidin-3-yl]sulfanylethanoylamino]benzoate Openeye Name: methyl 4-[[2-[(3R)-2,5-dioxo-1-phenyl-pyrrolidin-3-yl]sulfanylacetyl]amino]benzoate CAS Name: 4-[[2-[[(3R)-2,5-dioxo-1-phenyl-3-pyrrolidinyl]thio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[(3R)-2,5-dioxo-1-phenylpyrrolidin-3-yl]sulfanylacetyl]amino]benzoate Traditional Name: 4-[[2-[[(3R)-2,5-diketo-1-phenyl-pyrrolidin-3-yl]thio]acetyl]amino]benzoic acid methyl ester Formula: C20H18N2O5S MolecularWeight: 398.43232

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)CSC2CC(=O)N(C2=O)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)CS[C@@H]2CC(=O)N(C2=O)C3=CC=CC=C3

InChI

InChI=1S/C20H18N2O5S/c1-27-20(26)13-7-9-14(10-8-13)21-17(23)12-28-16-11-18(24)22(19(16)25)15-5-3-2-4-6-15/h2-10,16H,11-12H2,1H3,(H,21,23)/t16-/m1/s1