methyl 2-ethanoyl-4-(2-oxidanylidenepyrrolidin-1-yl)-1-pyrrolidin-2-ylcarbonyl-3-sulfanylidene-pyrrolidine-2-carboxylate

Systemtic Name: methyl 2-ethanoyl-4-(2-oxidanylidenepyrrolidin-1-yl)-1-pyrrolidin-2-ylcarbonyl-3-sulfanylidene-pyrrolidine-2-carboxylate Openeye Name: methyl 2-acetyl-4-(2-oxopyrrolidin-1-yl)-1-(pyrrolidine-2-carbonyl)-3-thioxo-pyrrolidine-2-carboxylate CAS Name: 2-acetyl-4-(2-oxo-1-pyrrolidinyl)-1-[oxo(2-pyrrolidinyl)methyl]-3-sulfanylidene-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 2-acetyl-4-(2-oxopyrrolidin-1-yl)-1-(pyrrolidine-2-carbonyl)-3-sulfanylidenepyrrolidine-2-carboxylate Traditional Name: 2-acetyl-4-(2-ketopyrrolidino)-1-prolyl-3-thioxo-pyrrolidine-2-carboxylic acid methyl ester Formula: C17H23N3O5S MolecularWeight: 381.44662

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1(C(=S)C(CN1C(=O)C2CCCN2)N3CCCC3=O)C(=O)OC

Isomeric SMILES

CC(=O)C1(C(=S)C(CN1C(=O)C2CCCN2)N3CCCC3=O)C(=O)OC

InChI

InChI=1S/C17H23N3O5S/c1-10(21)17(16(24)25-2)14(26)12(19-8-4-6-13(19)22)9-20(17)15(23)11-5-3-7-18-11/h11-12,18H,3-9H2,1-2H3