ethyl (3S,5S)-5-(carbamimidoylsulfanylmethyl)-3-ethyl-2-oxidanylidene-oxolane-3-carboxylate

Systemtic Name: ethyl (3S,5S)-5-(carbamimidoylsulfanylmethyl)-3-ethyl-2-oxidanylidene-oxolane-3-carboxylate Openeye Name: ethyl (3S,5S)-5-(carbamimidoylsulfanylmethyl)-3-ethyl-2-oxo-tetrahydrofuran-3-carboxylate CAS Name: (3S,5S)-5-[(carbamimidoylthio)methyl]-3-ethyl-2-oxo-3-oxolanecarboxylic acid ethyl ester IUPAC Name: ethyl (3S,5S)-5-(carbamimidoylsulfanylmethyl)-3-ethyl-2-oxooxolane-3-carboxylate Traditional Name: (3S,5S)-5-[(amidinothio)methyl]-3-ethyl-2-keto-tetrahydrofuran-3-carboxylic acid ethyl ester Formula: C11H18N2O4S MolecularWeight: 274.33662

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC(OC1=O)CSC(=N)N)C(=O)OCC

Isomeric SMILES

CC[C@]1(C[C@H](OC1=O)CSC(=N)N)C(=O)OCC

InChI

InChI=1S/C11H18N2O4S/c1-3-11(8(14)16-4-2)5-7(17-9(11)15)6-18-10(12)13/h7H,3-6H2,1-2H3,(H3,12,13)/t7-,11-/m0/s1